Support Documents for 

Significant New Use Rules (SNUR) on 

Premanufacture Notices (PMN) 

P-12-275 

EPA Docket EPA-HQ-OPPT-2012-0450 

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Index 

A-001 Structure Activity Team (SAT) Report for 

 PMN P-12-275 

A-002 Initial Review Engineering Report for 

 PMN P-12-275 

A-003 Initial Review Exposure Report for 

 PMN P-12-275 

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A-001 

Structure Activity Team (SAT) Report 

 for PMN P-12-275 

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SAT Report

PMN Number: P-12-0275

SAT Date: 4/10/2012

Print Date: 5/2/2012

Related cases:

Health related cases: 

Ecotox related cases: 

Concern levels:

Type of Concern: Health Eco Comments

Level of Concern: 2 2

 Persistence Bioaccum Toxicity Comments

2 32

Exposure Based Review:

Health: No

Ecotox: No

Routes of exposure: Health: Dermal Drinking Water Inhalation 

Ecotox: All releases to water

Fate: ;

Keywords:

 Keywords: 

SEVER IRR/POSS CORR E,S,L,MM,GI

ACUTE

LIVER

SENS-S

AQUATOX-A,C

Summary of Assessment:

 Fate:

Fate Summary: P-12-0275 = T-12-0008 

FATE: Estimations for covalent ion pair MW 435 C26H56ClP

Solid with MP = 132 C (E)

log Kow = 6.48 (E) 

S = Dispersible / 0.005 mg/L at 25 C (ICB / E)

VP < 1.0E-6 torr at 25 C (E)

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BP > 400 C (E)

H = 6.57E-2 (E)

log Koc = 7.66 (E)

log Fish BCF = 2.57 (E)

log Fish BAF = 4.40 (E) 

POTW removal (%) = 95 via sorption

Time for complete ultimate aerobic biodeg = mo

Sorption to soils/sediments = v.strong

Volatilization half-life from a standard river = 6 hrs

Volatilization half-life from a standard lake = 8 da

Atmospheric Oxidation Half-life = 4.3 hr via OH radical

PBT Potential: P2B3

*CEB FATE: Migration to ground water = negl

 Health:

 Health Summary: Absorption is nil through the skin for the neat material, 

but poor through the skin for the material in solution, and poor through the lung and GI tract, 

based on physical/chemical properties. There are concerns for severe irritation/possible 

corrosion to all exposed tissues, acute toxicity, and adverse effects to the liver, based on analogs 

and summary test data in the PMN MSDS (rat acute oral LD50 611 mg/kg, rat 4hr inhalation 

LC50 > 0.125 < 0.5 mg/l). There also is concern for dermal sensitization based on 

(positive in the mouse LLNA). 

 Test Data: 

Submitted with the PMN:

Salmonella assay negative with and without activation;

E. coli reverse mutation assay negative with and without activation

 Ecotox:

Test Organism Test 

Type

Test End 

Point

Predicted Measured Comments

fish 96-h LC50 2.0

daphnid 48-h LC50 1.8

green algal 96-h EC50 1.8

fish _ chronic value 0.11 CAR 18

daphnid _ chronic 

value

0.13 CAR 14

algal _ chronic 

value

0.45 CAR 4

Sewage Sludge 3-h EC50 _

Sewage Sludge _ Chronic 

Value

_

Ecotox Values Comments: Predictions are based on SAR-nearest analog method for cationic 

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surfactants-monoalkyl with 14 carbons in the largest hydrophobe;; SAR chemical class = 

surfactant-cationic-monoalkyl-C14; MW 435; pH7; effective concentrations based on 100% 

active ingredients and nominal concentrations; hardness <180.0 mg/L as CaCO3; and TOC 

<2.0 mg/L;

Factors Values Comments

Assessment Factor 10

Concentration of Concern 

(ppb)

11

SARs cationic surfactants

SAR Class surfactant-cationic-C14

Ecotox Category Cationic (quaternary ammonium) 

surfactants

Ecotox Factors Comments: 

 SAT Chair: J. Kwiat

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A-002 

Initial Review Engineering Report 

for PMN P-12-275 

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INITIAL REVIEW ENGINEERING REPORT 

PMN: 12-0275

Focus Ready Draft 4/19/2012

ENGINEER: Arnold \ AG

PV (kg/yr): 

SUBMITTER: Cytec Industries Inc.

USE: Chemical intermediate for production of a

proprietary chemical for the electronics industry. 

OTHER USES:

MSDS: Yes Label: No

Gen Eqpt: Eye Protection: Prevent eye and skin contact.

Wear eye/face protection such as chemical splash proof

goggles or face shield. // Skin Protection: Prevent

contamination of skin or clothing when removing

protective equipment. Wear impermeable gloves and

suitable protective clothing. // Engineering Measures:|

Utilize a closed system process where feasible. Where

this material is not used in a closed system, good

enclosure and local exhaust ventilation should be

provided to control exposure.

Respirator: Where exposures are below the established

exposure limit, no respiratory protection is required.

Where exposures exceed the established exposure limit,

use respiratory protection recommended for the material

and level of exposure.

Health Effects: Causes burns of eyes and skin. May be

fatal if inhaled.

TLV/PEL:

None Established

CRSS :

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Consumer Use: No

SAT (concerns) (04/10/2012):

Related Cases and Related Cases and Misc SAT Info:

Ecotox Related Cases: Analogs: 

 // Human Health Related Cases: 

Migration to groundwater: Negligible

PBT rating: P2B3T2 .

Health: 2 Dermal, Drinking Water, Inhalation

Eco: 2 Water (All releases to water with a CC = 11 ppb)

OCCUPATIONAL EXPOSURE RATING: 1A

NOTES & KEY ASSUMPTIONS:

Generated by the 06/07/2005 version of ChemSTEER. 

 

POLLUTION PREVENTION CONSIDERATIONS:

None.

EXPOSURE-BASED REVIEW: No

INITIAL REVIEW ENGINEERING REPORT 

PMN: 12-0275

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Use: Production of Proprietary Chemical for Electronics

Industry

Number of Sites/ Location: 1

SACHEM Inc. Cleburne TX

Days/yr: 100

Basis:

Process Description: Import PMN ( PMN suspension in

water; drums) --> Charge raw materials into process

vessel --> Reaction (PMN reacted) --> Final Product

Packaging

(per submission and CRSS)

ENVIRONMENTAL RELEASES ESTIMATE SUMMARY

IRER Note: The daily releases listed for any source below

may coincide with daily releases from the other sources

to the same medium. // Note PMN is consumed during

reaction, so equipment cleaning residuals not expected.

Submission estimates at most trace residuals may not be

consumed. Submission states there will be no discharges

to surface water from this operation.

Incineration

High End: 4.5E+0 kg/site-day over 100 days/yr from 1 site

or 4.5E+2 kg/yr

to: Off-site Incineration

from: Cleaning Liquid Residuals from Drums Used to

Transport the Raw Material

basis: EPA/OPPT Drum Residual Model, CEB standard 

residual. Submission states delivery containers will be

rinsed with water after each use, and rinse water is sent

to off-site incineration. 

 presumably from drum residual, to incineration.

Since customer site is identified by submitter, CEB

assesses release according to submission.

RELEASE TOTAL

4.5E+2 kg/yr - all sites

OCCUPATIONAL EXPOSURES ESTIMATE SUMMARY

Tot. # of workers exposed via assessed routes: 3

Basis: Submission estimates 1 worker. CEB assesses 3

workers/site as default minimum.

Inhalation:

negligible (VP < 0.001 torr)

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Dermal:

Exposure to Liquid at % concentration

High End: 9.2E+2 mg/day over 100 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.

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A-003 

Initial Review Exposure Report 

for PMN P-12-275 

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4/18/12 Page of 

INITIAL REVIEW EXPOSURE REPORT (IRExR) 

 Chemical ID: P-12-0275 Reviewer: Flessner/AG 

 

 

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

Exposure 

Scenario1 

 Water Landfill Stack Air Fugitive Air 

Drinking Water Fish Ingestion 

ADR LADD ADR LADD 7Q104

CC = 

11 

PDM 

Days 

Exceede

d 

LADD ADR LADD ADR LADD 

Release 

activity(ies)2

; exposure 

calculation(s)

3 

mg/kg/day m g/kg/day mg/kg/day mg/kg/day μg/l # Days mg/kg/day m g/kg/day mg/kg/day mg/kg/day mg/kg/day

USE: Max 

ADR 

--- --- --- --- --- --- --- 5.57E-03 --- --- --- 

USE: Max 

LADD 

--- --- --- --- --- --- --- --- 1 .22E-04 --- --- 

1 Exposure scenario titles consist of release activity followed by exposure calculation abbreviation. 

2 Release activities are from engineering report's Manufacturing (Mfg), Processing (Proc) and Use release 

activity labels. Multiple release activities are combined in one exposure 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: 

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4/18/12 Page of 

 INITIAL REVIEW EXPOSURE REPORT 

Chemical ID: P-12-0275 Assessor: Flessner/AG 

ENVIRONMENTAL RELEASES 

 Scenario#:1 Number of Release Sites: 

 Release Activity: USE: Max ADR 

 Release Description: WATER LANDFILL 

Non-sludge/Sludge 

STACK FUGITIVE 

Total Releases: 

 (k g/yr) (kg/yr) (kg/yr) (kg/yr) 

 

 Non-sludge/Sludge 

Release Days/yr: 

Per Site Release: 

 (kg /site/day) (kg/site/day) (kg/site/day) (kg/site/day) 

Remarks: 

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4/18/12 Page of 

INITIAL REVIEW EXPOSURE REPORT 

Chemical ID: P-12-0275 

INHALATION EXPOSURE ESTIMATES (POST-TREATMENT) 

SCENARIO #: 1 RELEASE ACTIVITY:USE: Max ADR 

RELEASE DESCRIPTION: 

METHOD OF CALCULATION: Screen3 

EXPOSED POPULATION: Adult 

Number of Sites: 

Per Site Fugitive Release: kg/site/day 

Fugitive Release Days per Year: days 

% Removal via Fugitive Release: % 

Total Fugitive Release: kg/yr 

Max Annual Average Air Concentration 

(Fugitive): 

0.00 μg/ m3

Max 24 Hour Average Air 

Concentration(Fugitive): 

0.00 μg/ m3

Per Site Stack Release: kg/site/day 

Stack Release Days per Year: days 

% Removal via Stack Release: % 

Total Stack Release: kg/yr 

Max Annual Average Air Concentration (Stack): 1.66 μg/m3

Max 24 Hour Average Air Concentration (Stack): 30.30 μg/m3

ASSUMPTIONS 

Exposure Units 

Results 

(Stack) 

Results 

(Fugitive) ED 

(years) 

AT 

(years) 

BW 

(kg) 

Inh. Rate 

(m3/hr) 

Cancer 

LADDpot (mg/kg/day) 1.22E-04 N/A 30.00 75.00 71.80 0.55 

LADCpot (mg/m3) 6.64E-04 N/ A 30.00 75.00 NA NA 

Acute 

ADRpot (mg/kg/day) 5.57E-03 N/A NA 1 day 71.80 0.55 

Inhalation Comments: 

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4/18/12 Page of 

 Stack Parameter Data Fugitive Parameter Data 

Stack Height 10.00 m Release Height: N/A 

Inside Stack 

Diameter: 

0.10 m Length of Release 

Opening: 

N/A 

Stack Gas Exit 

Velocity: 

0.10 m /sec Width of Release 

Opening: 

N/A 

Stack Gas 

Temperature: 

293.00 K 

 

 Meteorological and Terrain Information: 

Surrounding Land Use: Rural 

Terrain Height: 0.00 m 

Distance to Residence of Interest: 100.00 m 

Meteorological Class: Full 

Stability Class: NA 

Wind Speed: NA 

 

 Do wnwash Information: 

Facility Length: NA m 

Facility Width: NA m 

Facility Height: NA m 

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4/18/12 Page of 

 INITIAL REVIEW EXPOSURE REPORT 

Chemical ID: P-12-0275 Assessor: Flessner/AG 

ENVIRONMENTAL RELEASES 

 Scenario#:2 Number of Release Sites: 

 Release Activity: USE: Max LADD 

 Release Description: WATER LANDFILL 

Non-sludge/Sludge 

STACK FUGITIVE 

Total Releases: 

 (k g/yr) (kg/yr) (kg/yr) (kg/yr) 

 

 Non-sludge/Sludge 

Release Days/yr: 

Per Site Release: 

 (kg /site/day) (kg/site/day) (kg/site/day) (kg/site/day) 

Remarks: 

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4/18/12 Page of 

INITIAL REVIEW EXPOSURE REPORT 

Chemical ID: P-12-0275 

INHALATION EXPOSURE ESTIMATES (POST-TREATMENT) 

SCENARIO #: 2 RELEASE ACTIVITY:USE: Max LADD 

RELEASE DESCRIPTION: 

METHOD OF CALCULATION: Screen3 

EXPOSED POPULATION: Adult 

Number of Sites: 

Per Site Fugitive Release: kg/site/day 

Fugitive Release Days per Year: days 

% Removal via Fugitive Release: % 

Total Fugitive Release: kg/yr 

Max Annual Average Air Concentration 

(Fugitive): 

0.00 μg/ m3

Max 24 Hour Average Air 

Concentration(Fugitive): 

N/A μg/m 3

Per Site Stack Release: kg/site/day 

Stack Release Days per Year: days 

% Removal via Stack Release: % 

Total Stack Release: kg/yr 

Max Annual Average Air Concentration (Stack): 1.66 μg/m3

Max 24 Hour Average Air Concentration (Stack): N/A μg/m3

ASSUMPTIONS 

Exposure Units 

Results 

(Stack) 

Results 

(Fugitive) ED 

(years) 

AT 

(years) 

BW 

(kg) 

Inh. Rate 

(m3/hr) 

Cancer 

LADDpot (mg/kg/day) 1.22E-04 N/A 30.00 75.00 71.80 0.55 

LADCpot (mg/m3) 6.64E-04 N/ A 30.00 75.00 NA NA 

Acute 

ADRpot (mg/kg/day) N/A N/A NA 1 day 71.80 0.55 

Inhalation Comments: 

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4/18/12 Page of 

 Stack Parameter Data Fugitive Parameter Data 

Stack Height 10.00 m Release Height: N/A 

Inside Stack 

Diameter: 

0.10 m Length of Release 

Opening: 

N/A 

Stack Gas Exit 

Velocity: 

0.10 m /sec Width of Release 

Opening: 

N/A 

Stack Gas 

Temperature: 

293.00 K 

 

 Meteorological and Terrain Information: 

Surrounding Land Use: Rural 

Terrain Height: 0.00 m 

Distance to Residence of Interest: 100.00 m 

Meteorological Class: Full 

Stability Class: NA 

Wind Speed: NA 

 

 Do wnwash Information: 

Facility Length: NA m 

Facility Width: NA m 

Facility Height: NA m 

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