Compound: 1-EICOSANOL
SMILES: OCCCCCCCCCCCCCCCCCCCC
InChIKey: BTFJIXJJCSYFAL-UHFFFAOYSA-N
Synonyms: 1-EICOSANOL, Icosan-1-ol, 629-96-9, Arachidyl alcohol, Arachidic alcohol, Arachic alcohol, Eicosyl alcohol, N-Eicosanol, 1-Icosanol, N-1-Eicosanol, Pri-N-eicosyl alcohol, NSC 120887, HSDB 5731, 1QR1QRA9BU, EINECS 211-119-4, AI3-36485, NSC-120887, 1-EICOSANOL [HSDB], DTXSID0027272, CHEBI:75627, EC 211-119-4, ARACHIDYL ALCOHOL [USP-RS], ARACHIDYL ALCOHOL (USP-RS), nEicosanol, arachyl alcohol, n1Eicosanol, Icosan1ol, prinEicosyl alcohol, RefChem:432161, DTXCID007272, ARACHIDYL ALCOHOL [INCI], 211-119-4, InChI=1/C20H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h21H,2-20H2,1H, EICOSANOL, eicosan-1-ol, icosanol, MFCD00002938, 28679-05-2, Arachinyl alcohol, Eicosanol-(1), UNII-1QR1QRA9BU, a-eicosanol, 1-Ecosanol, 1-Prydroxyeicosane, n-eicosan-1-ol, N-Eicosanol (d41), 1-Eicosanol, 98%, 1-Eicosanol (Standard), A1EQ8, SCHEMBL108302, SCHEMBL158754, SCHEMBL630625, CHEMBL451717, orb1296988, orb3026102, QSPL 202, SCHEMBL1435928, SCHEMBL2069657, SCHEMBL3394049, SCHEMBL5820037, SCHEMBL9871388, 1-icosanol (ACD/Name 4.0), SCHEMBL18315999, SCHEMBL28257054, HY-W004263R, ZNA55389, LMFA05000221, NSC120887, SBB060169, AKOS015839826, CS-W004263, EBC-389249, FA68034, HY-W004263, MSK159776-100T, 1-Eicosanol, technical, >=90% (GC), 1-Eicosanol, purum, >=97.0% (GC), BP-41333, BS-51501, Eicosanol Solution in Toluene, 100ug/mL, SY049846, DB-250389, E0004, NS00004340, ST51046403, H10676, Q4783532, ABA1F4B5-39FD-4206-A0A7-70D182257EEE, Arachidyl alcohol, United States Pharmacopeia (USP) Reference Standard
Theoretical properties:
molecular_formula: C20H42O
molecular_weight: 298.5 g/mol
exact_mass: 298.323565959 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 18
heavy_atom_count: 21
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: White, wax-like solid
color: White, wax-like solid
boiling_point: 309 °C at 750 mm Hg; 222 °C at 3 mm Hg
melting_point: 66.1 °C
density: 0.8405 at 20 °C/4 °C
solubility: Very soluble in acetone; soluble in petroleum ether; slightly soluble in ethanol, chloroform
flash_point: 195 °C
vapor_pressure: 0.00000004 [mmHg]
Descriptions:
pubchem: Icosan-1-ol is a long-chain primary fatty alcohol that is icosane in which one of the terminal methyl hydrogens is replaced by a hydroxy group. It has a role as a volatile oil component, a plant metabolite and a human metabolite. It is an icosanol and a long-chain primary fatty alcohol.
chebi: A long-chain primary fatty alcohol that is icosane in which one of the terminal methyl hydrogens is replaced by a hydroxy group.
chembl: 1-EICOSANOL is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Arachidyl alcohol (icosan-1-ol), is a waxy substance used as an emollient in cosmetics. It is a straight-chain fatty alcohol with 20 carbon atoms, typically obtained via the hydrogenation of arachidic acid or arachidonic acid, both of which are present in peanut oil. Its name is derived from that of the peanut plant (Latin: arachis).