# Support Documents for Significant New Use Rule (SNUR) on Premanufacture Notice (PMN)
P-12-33

EPA Docket EPA-HQ-OPPT-2012-0182

# Index A-001 Structure Activity Team (SAT) Report for PMN P-12-33 A-002 Initial Review Engineering Report for PMN P-12-33 A-003 Initial Review Exposure Report for PMN P-12-33

# A-001 Structure Activity Team (SAT) Report
for PMN P-12-33

## SAT Report PMN Number: P-12-0033 SAT Date: 11/8/2011 Print Date: 12/5/2011

Related cases : CBI: Yes Health related cases: Ecotox related cases :

Concern levels : 

### Type of Concern: Health Eco Comments Level of Concern: 1-2 2

Persistence Bioaccum Toxicity Comments 1 12

Exposure Based Review : Health: N o Ecotox: N o Routes of exposure : Health: Dermal Drinking Water Inhalation Ecotox: All releases to water Fate: ; Keywords : Keywords: N EURO, REPRO-M, LIVER, KIDNEY, LUNG, DEVEL, HYPERSENS, AQUATOX-A,C Summary of Assessment :
Fate : Fate Summary: P-12-0033 FATE: Liquid with MP < 25 C (E) log Kow = 3.74 (E) S = 61 mg/L at 25 C (E) VP = 2.2E-2 torr at 25 C ( N OMO5) BP = 250 C ( N OMO5) based on 122-124 C @ 9 mm Hg (M) H = 3.97E-5 (E) log Koc = 2.66 (E)

### log Fish BCF = 2.13 (E) log Fish BAF = 2.17 (E) POTW removal (%) = 50-90 via biodeg Time for complete ultimate aerobic biodeg = mo Sorption to soils/sediments = low - moderate Volatilization half-life from a standard river = 22 hrs Volatilization half-life from a standard lake = 15 da Atmospheric Oxidation Half-life = 61hr via OH radical PBT Potential: P1B1 *CEB FATE: Migration to ground water = moderate - rapid

Health : Health Summary: Absorption is good all routes based on analogs. Expect hydrolysis of the ester by esterases in the body to yield tert-butylbenzoic acid. Concerns for neurotoxic effects, male reproductive toxicity, liver, kidney, and lung effects were supported in the Standard Review for P-tert-Butylbenzoic acid was reported to cause lesions in the kidney tubules, testes, and spinal cord at 0.52 g/m3 and greater in a 4-hr inhalation study in rats . The Standard Review for concluded that p-tert-butylbenzoic acid has been shown to induce testicular, kidney, and liver damage as low as 5 mg/kg when given orally over a 90-day period. With no established NOAEL. There is also concern for developmental toxicity and hypersensitivity by analogy to benzoic acid. Low moderate
concern.
Ecotox :

Test Organism Tes t Typ

e Test End Point Predicted Measured Comments

fish 96- h LC50 2.5
daphnid 48- h LC50 4.3

green algal 96- h EC50 1.4

fish

_ chronic value 0.13
daphnid

_ chronic value 1.8
algal

_ chronic value 0.62
Sewage Sludge 3-h EC50

_ Sewage Sludge _ Chronic Value _

### Ecotox Values Comments: Predictions are based on SARs for esters; SAR chemical class = ester; MW 192; log Kow = 3.74 (EPI); liquid with mp = unknown (P); S = 61 mg/L at 25 C (P); p H7; effective concentrations based on 100% active ingredients and nominal concentrations; hardness <150.0 mg/L as CaCO3; and TOC <2.0 mg/L;
Factors Values Comments Assessment Factor 10 Concentration of Concern ( p pb) 13

SARs esters SAR Class ester new chemicals category: esters Ecotox Category
Ecotox Factors Comments:
SAT Chair: Becky Jones

# A-002 Initial Review Engineering Report
for PMN P-12-33INITIAL REVIEW ENGINEERING REPORT PMN: 12-0033 Focus Ready Draft 11/21/2011 ENGINEER: Jon \ CLM PV (kg/yr): 25,000 Import Only
SUBMITTER: Aceto Corporation USE: Chemical intermediate for a coupler for imaging products. L-11-344 from the same submitter is for the same use. Synthetic sequence: P-12-33 -> P-11-578 -> P-11-0579 + P-11-580 -> P-11-581 -> P-11-582 -> P-11-583 (ER, P-03-628). OTHER USES: Analog , STN CA 155:94300: polymerization catalyst; Analog : chemical intermediate; STN CA 144:207370: chemical intermediate to prepare herbicides; Analog : plasticizer; Analog : wet cleaning system. MSDS: Yes Label: Yes Gen Eqpt: Eye/Face: tightly fitting safety goggles. // Skin: wear protective gloves/clothing. Respirator: In case of insufficient ventilation wear suitable respiratory equipment. Health Effects: Eyes: contact with eyes may cause irritation. Avoid contact with eyes. // Skin: may be harmful by skin contact. Substance may cause slight skin irritation. Avoid contact with skin. // Inhalation: may be harmful by inhalation. May cause irritation of the mucous membranes. May cause irritation of respiratory tract. Avoid breathing vapors or mists. // Ingestion: may be harmful if swallowed. Do not ingest. TLV/PEL: none established

CRSS : Chemical Name: Benzoic acid, 4-(1,1-dimethylethyl)-, methyl ester S-H20: 0.061 g/L @ VP: 2.2E-2 torr @ MW: 192.00 %<500 %<1000 Physical State and Misc CRSS Info: Neat: Liquid Mfg: NK: Imported Proc/Form: NA End Use: Destroyed. Submitted Data: Transparent, colorless liquid; BP = 122-124°C at 9 torr (MSDS); density = 0.995 g/cm3. Literature Data (STN eProp): BP = 110-112°C at 5 torr. Estimated Data (NOMO5 with 122°C at 9 torr): BP = 249.9°C at 760 torr; VP = 0.022 torr. Estimated Data (EPI with MP = 20°C): WS = 0.061 g/L; log P = 3.74; BP = 252.15°C; VP = 0.0243 torr. Estimated Data (STN/ACD Labs): WS = 0.15 g/L; log P = 3.972; BP = 257.6°C; VP = 0.0144 torr.

Consumer Use: No SAT (concerns) (11/08/2011): Related Cases and Related Cases and Misc SAT Info: Ecotox Related Cases: Page 1Analogs: | Human Health Related Cases: | Migration to groundwater: Moderate to Rapid PBT rating: P1B1T1 . Health: 1-2 Dermal, Drinking Water, Inhalation Eco: 2 Water (All releases to water with a CC = 13 ppb)
OCCUPATIONAL EXPOSURE RATING: 2A
NOTES & KEY ASSUMPTIONS: Generated by the 06/07/2005 version of ChemSTEER. This PMN was formerly submitted as ; the submitter now anticipates increased demand and submitted a full PMN. This PMN is import only and is used as a chemical intermediate. Therefore, only end use as an intermediate is assessed. // Note, SAT concerns for dermal, inhalation, drinking water, and all releases to water with a CoC = 13 ppb and migration to gw = moderate to rapid. // This PMN is volatile (VP > 0.001), therefore, air releases are assessed. // For USE: This IRER assesses releases from container cleaning to incineration or landfill (submission); releases from equipment cleaning to uncertain media; air releases are assessed during unloading, container cleaning, and equipment cleaning (VP > 0.001 torr). Both dermal and inhalation exposure are assessed. // Same-submitter, same-use past case and different-submitter, same-use (intermediate) past case were referenced for consistency. Both past cases did not have the binding option marked and were assessed at a PV of 10,000 kg/yr (consistent with this IRER). Both past cases were import only (consistent with this IRER). Both past cases were non-volatile. This IRER assesses a volatile liquid and assesses air releases. Both past cases assess dermal and inhalation exposure (consistent with this IRER). Both past cases assume full consumption of the PMN during use as an intermediate (consistent with this IRER).

POLLUTION PREVENTION CONSIDERATIONS: None.

EXPOSURE-BASED REVIEW: No
INITIAL REVIEW ENGINEERING REPORT PMN: 12-0033 USE: Chemical Intermediate Number of Sites/ Location: 1 Eastman Business Park Rochester NY 14652 Days/yr: 63 Basis: Submission specifies 1 site, 400 kg/bt. ChemSTEER calculates 63 bt/yr. Process Description: PMN (100%, liquid) is imported ---> Charged to reaction vessel with other raw materials ---> Raw materials are heated to form another chemical substance ---> PMN destroyed (submission, CRSS).

ENVIRONMENTAL RELEASES ESTIMATE SUMMARY IRER Note: The daily releases listed for any source below may coincide with daily releases from the other sources Page 2to the same medium. Water or Incineration or Landfill Conservative: 4.0E+0 kg/site-day over 63 days/yr from 1 site or 2.5E+2 kg/yr to: solvent recovery (submission) from: Equipment Cleaning Losses of Liquids from a Single, Large Vessel basis: EPA/OPPT Single Vessel Residual Model, CEB standard 1% residual. The submission estimates <0.5 kg/bt released to a solvent recovery process from equipment cleaning. Due to uncertainty in the effectiveness of this process, CEB assesses release to uncertain media using the CEB standard model. CEB standard estimate is an order of magnitude higher than the submitter estimate. Air Typical: 4.5E-5 kg/site-day over 63 days/yr from 1 site Worst Case: 9.0E-5 kg/site-day over 63 days/yr from 1 site to: air (model) from: Unloading Liquid Raw Material from Drums basis: EPA/OAQPS AP-42 Loading Model. Air Output 2: 1.5E-6 kg/site-day over 63 days/yr from 1 site to: air (model) from: Cleaning Liquid Residuals from Drums Used to Transport the Raw Material basis: EPA/OPPT Penetration Model. Air Output 2: 3.0E-3 kg/site-day over 63 days/yr from 1 site to: air (model) from: Equipment Cleaning Losses of Liquids from a Single, Large Vessel basis: EPA/OPPT Mass Transfer Coefficient Model. Incineration or Landfill High End: 1.2E+1 kg/site-day over 63 days/yr from 1 site or 7.5E+2 kg/yr to: incineration or landfill (submission) from: Cleaning Liquid Residuals from Drums Used to Transport the Raw Material basis: EPA/OPPT Drum Residual Model, CEB standard 3% residual. The submission estimates <0.5 kg/bt PMN is released to incineration or landfill from container cleaning. As conservative, CEB assesses release to incineration or landfill using the CEB standard model.

RELEASE TOTAL 1.0E+3 kg/yr - all sites

OCCUPATIONAL EXPOSURES ESTIMATE SUMMARY Tot. # of workers exposed via assessed routes: 3 Basis: The submission estimates 3 workers/site are exposed to 100% PMN during unloading and cleaning. Inhalation: Exposure to Vapor (Class II) Typical: 2.2E-2 mg/day over 63 days/yr Page 3Worst Case: 1.3E+0 mg/day over 63 days/yr Number of workers (all sites) with inhalation exposure: 3 Basis: Unloading Liquid Raw Material from Drums; EPA/OPPT Mass Balance Model. NOTE: The respirator class is: II. Gas/vapor (all substances in the gas form).

INHALATION MONITORING DATA REVIEW 1) Uncertainty (estimate based on model, regulatory limit or data not specific to industry): Yes 2)a) Exposure level > 1 mg/day? Yes OR b) Hazard Rating for health of 2 or greater? 1-2 No Inhalation Monitoring Data Desired? Yes (both criteria met) Dermal: Exposure to Liquid at 100.00% concentration High End: 1.8E+3 mg/day over 63 days/yr Number of workers (all sites) with dermal exposure: 3 Basis: Unloading Liquid Raw Material from Drums; EPA/OPPT 2-Hand Dermal Contact with Liquids Model.

Page 4

# A-003 Initial Review Exposure Report
for PMN P-12-3311/18/2011 Page of



### INITIAL REVIEW EXPOSURE REPORT (IRExR) Chemical ID: P-12-0033 Reviewer: Bevington/BC

Results Table: Dose, Concentration, and Days Exceeded Results Summary

Exposure Scenario 1 Water Landfill Stack Air Fugitive Air

Drinking Water Fish Ingestion ADR LADD ADR LADD 7Q10 4 CC =

13 PDM Days Exceeded LADD ADR LADD ADR LADD

Release activity(ies) 2 ; exposure calculation(s) 3 mg/kg/day mg/kg/day mg/kg/day mg/kg/day μg/l # Days mg/kg/day mg/kg/day mg/kg/day mg/kg/day mg/kg/day

USE: Max ADR: max acute eco 1.09E-04 --- 1.37E-04 --- 1.90E+00 --- --- --- --- --- ---

USE: PDM1 --- --- --- --- 1.90E+00 0 --- --- --- --- --- USE: Max LADD --- 7.55E-07 --- 4.40E-07 --- --- 5.94E-04 --- --- --- ---

1 Exposure scenario titles consist of release activity followed by exposure calculation abbreviation. 2 Release activities are from engineering report's Manufact uring (Mfg), Processing (Proc) and Use release activity labels. Multiple release activities are combined in one exposu re scenario if their releases occur at same location. 3 Exposure calculations are Acute Dose Rate (ADR), Lifetime Average Daily Dose (LADD), and Probabilistic Dilution Model (PDM). There may be one, two, or all three exposure calculations per exposure scenario. CC is the aquatic concentration of concern. 4 This column displays concentration values for the 7Q10 streamflow, which is defined as the average daily streamflow of the seven consecutive days of lowest flow within a ten year period.

Remarks:11/18/2011 Page of

INITIAL REVIEW EXPOSURE REPORT

Chemical ID: P-12-0033 Assessor: Bevington/BC
ENVIRONMENTAL RELEASES
Scenario#:1 Number of Release Sites: 1. Release Activity: USE: Max ADR Release Description: WATER LANDFILL Non-sludge/Sludge STACK FUGITIVE

Total Releases: 252.00 0.00 N/A N/A (kg/yr) (kg/yr) (kg/yr) (kg/yr)

Non-sludge/Sludge Release Days/yr: 63.00 0.00/0.00 N/A N/A
Per Site Release: 4.00 0.00/0.00 N/A N/A (kg/site/day) (kg/site/day) (kg/site/day) (kg/site/day)

Remarks:11/18/2011 Page of

INITIAL REVIEW EX POSURE REPORT

Chemical ID: P-12-0033 SITE-SPECIFIC HUMAN AND AQUATIC EXPOSURES TO SURFACE WATER RELEASES

SCENARIO NUMBER:1 RELEASE ACTIVITY: USE: Max ADR
FACILITY NAME: EASTMAN KODAK CO
FACILITY LOCATION: ROCHESTER NY 14652
RECEIVING WATER NAME: GENESEE R
REACH NUMBER: 04130003001 FACILITY ON REACH: Yes DISCHARGE TYPE: Direct
NPDES PERMIT #: NY0001643 EXPOSED POPULATION: Adult

WWT REMOVAL (%) RELEASE DAYS PRETREATMENT RELEASE (kg/site/day) POSTTREATMENT RELEASE (kg/site/day) DWT (%) BCF (L/kg)
50. 63. 4. 2.00 0.00 136.00

AQUATIC EXPOSURE ESTIMATES - SURFACE WATER
FLOW DESCRIPTOR Harmonic Mean 30Q5 7Q10 1Q10 PLANT FLOW (MLD) 3565.85 1528.47 1054.21 851.75 NA CONCENTRATION ( μ g/L) 0.56 1.31 1.90 2.35 NA

DRINKING WATER INGESTION AND FISH INGESTION EXPOSURE ESTIMATES

Exposure Units Drinking Water Results Drinking Water Units Fish Ingestion Results Fish Ingestion Units
Cancer

LADD pot 7.55E-07 mg/kg/day 4.40E-07 mg/kg/day
LADC pot 3.87E-05 mg/L 5.27E-03 mg/kg
Acute

ADR pot 1.09E-04 mg/kg/day 1.37E-04 mg/kg/day

Surface Water Comments:11/18/2011 Page of

INITIAL REVIEW EXPOSURE REPORT

Chemical ID: P-12-0033 Assessor: Bevington/BC
ENVIRONMENTAL RELEASES
Scenario#:2 Number of Release Sites: 1. Release Activity: USE: PDM1 Release Description: WATER LANDFILL Non-sludge/Sludge STACK FUGITIVE

Total Releases: 252.00 0.00 N/A N/A (kg/yr) (kg/yr) (kg/yr) (kg/yr)

Non-sludge/Sludge Release Days/yr: 63.00 0.00/0.00 N/A N/A
Per Site Release: 4.00 0.00/0.00 N/A N/A (kg/site/day) (kg/site/day) (kg/site/day) (kg/site/day)

Remarks:11/18/2011 Page of

INITIAL REVIEW EX POSURE REPORT

Chemical ID: P-12-0033 SITE-SPECIFIC HUMAN AND AQUATIC EXPOSURES TO SURFACE WATER RELEASES

SCENARIO NUMBER:2 RELEASE ACTIVITY: USE: PDM1
FACILITY NAME: EASTMAN KODAK CO
FACILITY LOCATION: ROCHESTER NY 14652
RECEIVING WATER NAME: GENESEE R
REACH NUMBER: 04130003001 FACILITY ON REACH: Yes DISCHARGE TYPE: Direct
NPDES PERMIT #: NY0001643 EXPOSED POPULATION: Adult

WWT REMOVAL (%) RELEASE DAYS PRETREATMENT RELEASE (kg/site/day) POSTTREATMENT RELEASE (kg/site/day) DWT (%) BCF (L/kg)
50. 63. 4. 2.00 0.00 136.00

AQUATIC EXPOSURE ESTIMATES - SURFACE WATER
FLOW DESCRIPTOR Harmonic Mean 30Q5 7Q10 1Q10 PLANT FLOW (MLD) 3565.85 1528.47 1054.21 851.75 NA CONCENTRATION ( μ g/L) 0.56 1.31 1.90 2.35 NA

DRINKING WATER INGESTION AND FISH INGESTION EXPOSURE ESTIMATES

Exposure Units Drinking Water Results Drinking Water Units Fish Ingestion Results Fish Ingestion Units
Cancer

LADD pot 7.55E-07 mg/kg/day 4.40E-07 mg/kg/day
LADC pot 3.87E-05 mg/L 5.27E-03 mg/kg
Acute

ADR pot 1.09E-04 mg/kg/day 1.37E-04 mg/kg/day

Surface Water Comments:11/18/2011 Page of

INITIAL REVIEW EX POSURE REPORT Chemical ID: P-12-0033

SITE-SPECIFIC HUMAN AND AQUATIC EXPOSURES TO SURFACE WATER RELEASES

SCENARIO NUMBER: 2 RELEASE ACTIVITY: USE: PDM1
FACILITY NAME: EASTMAN KODAK CO
FACILITY LOCATION: ROCHESTER NY 14652
RECEIVING STREAM NAME: GENESEE R
REACH NUMBER: 04130003001 FACILITY ON REACH: Yes DISCHARGE TYPE: Direct
NPDES PERMIT NUMBER: NY0001643 GAGING STATION ID: N/A GAGING STATION PERIOD OF RECORD: N/A GAGING STATION NUMBER OF OBSERVATIONS: N/A NUMBER OF STATIONS ON REACH: N/A

MEAN FLOW (MLD): 6914.59 7q10 FLOW (MLD): 1054.21 EFFLUENT FLOW (MLD):126.89

RESULTS

COC ( μ g/L) Percent of Year COC Exceeded Number of Days COC Exceeded Release days/year Pre-treatment Loading (kg/site/day) Waste Water Treatment (%)

13.00 0 0 63.00 4.00 50.0011/18/2011 Page of

INITIAL REVIEW EXPOSURE REPORT

Chemical ID: P-12-0033 Assessor: Bevington/BC
ENVIRONMENTAL RELEASES
Scenario#:3 Number of Release Sites: 1. Release Activity: USE: Max LADD Release Description: WATER LANDFILL Non-sludge/Sludge STACK FUGITIVE

Total Releases: 252.00 1008.00 N/A N/A (kg/yr) (kg/yr) (kg/yr) (kg/yr)

Non-sludge/Sludge Release Days/yr: 1.00 1.00/0.00 N/A N/A
Per Site Release: 252.00 1008.00/0.00 N/A N/A (kg/site/day) (kg/site/day) (kg/site/day) (kg/site/day)

Remarks:11/18/2011 Page of

INITIAL REVIEW EX POSURE REPORT

Chemical ID: P-12-0033 SITE-SPECIFIC HUMAN AND AQUATIC EXPOSURES TO SURFACE WATER RELEASES

SCENARIO NUMBER:3 RELEASE ACTIVITY: USE: Max LADD
FACILITY NAME: EASTMAN KODAK CO
FACILITY LOCATION: ROCHESTER NY 14652
RECEIVING WATER NAME: GENESEE R
REACH NUMBER: 04130003001 FACILITY ON REACH: Yes DISCHARGE TYPE: Direct
NPDES PERMIT #: NY0001643 EXPOSED POPULATION: Adult

WWT REMOVAL (%) RELEASE DAYS PRETREATMENT RELEASE (kg/site/day) POSTTREATMENT RELEASE (kg/site/day) DWT (%) BCF (L/kg)
50. 1. 252. 126.00 0.00 136.00

AQUATIC EXPOSURE ESTIMATES - SURFACE WATER
FLOW DESCRIPTOR Harmonic Mean 30Q5 7Q10 1Q10 PLANT FLOW (MLD) 3565.85 1528.47 1054.21 851.75 NA CONCENTRATION ( μ g/L) N/A N/A N/A N/A NA

DRINKING WATER INGESTION AND FISH INGESTION EXPOSURE ESTIMATES

Exposure Units Drinking Water Results Drinking Water Units Fish Ingestion Results Fish Ingestion Units
Cancer

LADD pot 7.55E-07 mg/kg/day 4.40E-07 mg/kg/day
LADC pot 3.87E-05 mg/L 5.27E-03 mg/kg
Acute

ADR pot N/A mg/kg/day N/A mg/kg/day

Surface Water Comments:11/18/2011 Page of

INITIAL REVIEW EX POSURE REPORT Chemical ID: P-12-0033

DRINKING WATER EXPOSURE ESTIMATES FROM LANDFILL RELEASES

SCENARIO #: 3 ACTIVITY: USE: Max LADD
RELEASE DESCRIPTION:
EXPOSED POPULATION: Adult

NUMBER OF SITES NON-SLUDGE LANDFILL RELEASE AND DAYS OF RELEASE (kg/site/day)/(days) LANDFILLED SLUDGE 1 AND DAYS OF RELEASE (kg/site/day)/(days) MIGRATION DESCRIPTOR 2 ADSORPTION TO WASTEWATER SLUDGE (%) DRINKING WATER TREATMENT (%)

1. 1008.00/1.00 0.00/0.00 Rapid 0.00 0.00

1 Landfilled sludge equals the fraction adsorbed to wastewater treatment sludge times the surface water pre-treatment release.

2 Migration Descriptor Log Koc Groundwater Concentration (GWC) (mg/L per kg release) Negligible no migration None Negligible to slow > 4.5 3.21E-6 Slow <4.5 to 3.5 2.67E-5 Moderate <3.5 to 2.5 5.95E-5 Rapid <2.5 7.55E-5

ASSUMPTIONS Exposure Units Results ED (years) AT (years) BW (kg) IR (L/day) Cancer LADD pot (mg/kg/day) 5.94E-04 30.00 75.00 71.80 1.40 LADC pot (mg/L) 3.04E-02 30.00 75.00 NA NA

REMARKS: