Compound: 1-DODECANOL
SMILES: OCCCCCCCCCCCC
InChIKey: LQZZUXJYWNFBMV-UHFFFAOYSA-N
Synonyms: 1-DODECANOL, Dodecan-1-ol, Dodecyl alcohol, Dodecanol, 112-53-8, Lauryl alcohol, n-Dodecyl alcohol, Lauric alcohol, Laurinic alcohol, Undecyl carbinol, Dodecylalcohol, n-Dodecanol, 1-Dodecyl alcohol, Pisol, Dodecyl alcoho, n-Dodecan-1-ol, Lorol 5, Lorol 7, Duodecyl alcohol, Lauryl 24, Alcohol C-12, Alfol 12, Lorol 11, 1-Hydroxydodecane, Siponol L5, Dytol J-68, Karukoru 20, Lauroyl alcohol, Siponol 25, Cachalot L-50, Cachalot L-90, n-Lauryl alcohol, Sipol L12, Siponol L2, Lorol, EPAL 12, C12 alcohol, Hainol 12SS, Hydroxydodecane, Conol 20P, Conol 20PP, Adol 10, Adol 12, Dodecanol-1, n-Lauryl alcohol, primary, Nacol 12-96, CO-1214, Alcohol C12, CO-1214N, CO-1214S, MFCD00004753, FEMA No. 2617, NAA 42, MA-1214, Lipocol L, 27342-88-7, S 1298, Lorol C12, DTXSID5026918, Co-1214S1-dodecanol, 178A96NLP2, NSC-3724, Lauryl Alcohol; 1-Dodecanol, DTXCID906918, Adol 11, Lorol C 12, FEMA Number 2617, Dytol J-68 (VAN), Lorol C 12/98, 1DO, CAS-112-53-8, CCRIS 662, Dodecanol, 1-, HSDB 1075, NSC 3724, EINECS 203-982-0, BRN 1738860, laurylalcohol, Lorol special, UNII-178A96NLP2, AI3-00309, Domiphen Impurity 3, Philcohol 1200, LAUREX NC, 1-Dodecanol (Standard), LAUREX L1, 1-Dodecanol 100 microg/mL in Acetonitrile, 1-DODECANOL [MI], 1-Dodecanol, 98.0%, EC 203-982-0, SCHEMBL6844, 1-DODECANOL [HSDB], SCHEMBL79575, SCHEMBL93237, LAURYL ALCOHOL [FCC], 4-01-00-01844 (Beilstein Handbook Reference), CHEMBL24722, LAURYL ALCOHOL [FHFI], SCHEMBL168859, SCHEMBL991227, C12H25OH, orb1298051, orb3139115, SCHEMBL8433774, SCHEMBL9191327, WLN: Q12, Lauryl alcohol, >=98%, FG, NACOL 12-99 ALCOHOL, LAURYL ALCOHOL [USP-RS], SCHEMBL11744779, SCHEMBL16012697, SCHEMBL19681410, SCHEMBL26697594, SCHEMBL28251564, 1-dodecanol (ACD/Name 4.0), 1-Dodecanol, analytical standard, ALFOL 1216 CO ALCOHOL, CHEBI:28878, HY-Y0289R, NSC3724, 12 OH, 1-Dodecanol, reagent grade, 98%, CS-D1360, HY-Y0289, Tox21_202124, Tox21_300120, EBC-47485, LMFA05000001, MSK160827, SBB008734, STL301829, CACHALOT L-90 LAURYL ALCOHOL, Co 12Co-1214Co-1214N, AKOS009031450, DB06894, FD54786, MSK160827-100M, 1-Dodecanol, ACS reagent, >=98.0%, NCGC00164341-01, NCGC00164341-02, NCGC00164341-03, NCGC00253987-01, NCGC00259673-01, BP-31213, CS-16955, DB-003637, DB-312102, 1-Dodecanol, SAJ special grade, >=97.0%, 1-Dodecanol, Selectophore(TM), >=98.0%, 1-dodecanol; dodecyl alcohol; lauryl alcohol, D0978, NS00002080, ST51046177, 1-Dodecanol Solution in Methanol, 100ug/mL, EN300-20043, C02277, F358252, Q161617, Z104476554, Lauryl alcohol, United States Pharmacopeia (USP) Reference Standard
Theoretical properties:
molecular_formula: C12H26O
molecular_weight: 186.33 g/mol
exact_mass: 186.198365449 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 10
heavy_atom_count: 13
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Leaflets from dilute alcohol
color: Leaflets from dilute alcohol
odor: CHARACTERISTIC FATTY ODOR; UNPLEASANT AT HIGH CONCN BUT DELICATE & FLORAL ON DILUTION
boiling_point: 498 °F at 760 mmHg (USCG, 1999)
melting_point: 75 °F (USCG, 1999)
density: 0.831 at 75.2 °F (USCG, 1999) - Less dense than water; will float
solubility: In water, 4 mg/L at 25 °C
flash_point: 260 °F (USCG, 1999)
vapor_pressure: 0.000848 [mmHg]
Descriptions:
pubchem: Dodecan-1-ol is a primary alcohol that is dodecane in which a hydrogen from one of the methyl groups is replaced by a hydroxy group. It is registered for use in apple and pear orchards as a Lepidopteran pheromone/sex attractant, used to disrupt the mating behaviour of certain moths whose larvae destroy crops. It has a role as an insect attractant, an insecticide, a pheromone, a cosmetic, a plant metabolite and a bacterial metabolite. It is a primary alcohol and a dodecanol.
chebi: A primary alcohol that is dodecane in which a hydrogen from one of the methyl groups is replaced by a hydroxy group. It is registered for use in apple and pear orchards as a Lepidopteran pheromone/sex attractant, used to disrupt the mating behaviour of certain moths whose larvae destroy crops.
chembl: DODECANOL is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Dodecanol , or lauryl alcohol, is an organic compound produced industrially from palm kernel oil or coconut oil. It is a fatty alcohol. Sulfate esters of lauryl alcohol, especially sodium lauryl sulfate, are very widely used as surfactants. Sodium lauryl sulfate and the related dodecanol derivatives ammonium lauryl sulfate and sodium laureth sulfate are all used in shampoos. Dodecanol is tasteless, colorless, and has a floral odor.