Compound: benzyl alcohol
SMILES: OCc1ccccc1
InChIKey: WVDDGKGOMKODPV-UHFFFAOYSA-N
Synonyms: benzyl alcohol, phenylmethanol, benzenemethanol, 100-51-6, phenylcarbinol, Benzoyl alcohol, Benzenecarbinol, Hydroxytoluene, alpha-Toluenol, Phenylmethyl alcohol, (Hydroxymethyl)benzene, Phenolcarbinol, alpha-hydroxytoluene, Alcool benzylique, Benzal alcohol, Methanol, phenyl-, benzylic alcohol, Benzylicum, hydroxymethylbenzene, Phenylcarbinolum, Ulesfia, Alcohol, Benzyl, Alcohol bencilico, alcoholum benzylicum, FEMA No. 2137, NCI-C06111, Alcool benzilico, Alcohol,benzyl, DTXSID5020152, Alcohol benzylicus, NSC-8044, LKG8494WBH, INS NO.1519, INS-1519, DTXCID70152, CHEBI:17987, E-1519, hydroxytoluenes, Protocoxil, phenyl carbinol, RefChem:6391, Zilactin Early Relief Cold Sore, CHEBI:24751, 202-859-9, 835-314-4, benzylalcohol, 66072-40-0, Euxyl K 100, Phenyl-Methanol, BENZYL-ALCOHOL, Bentalol, Aromatic alcohol, Caswell No. 081F, .alpha.-Toluenol, Benzyl alcohol (natural), Alcool benzilico [DCIT], Itch-X, benzenmethanol, .alpha.-Hydroxytoluene, Benzylalkohol, Aromatic primary alcohol, Alcool benzylique [INN-French], Benzyl alkohol, Alcohol bencilico [INN-Spanish], Methanol benzene, Alcoholum benzylicum [INN-Latin], NSC 8044, phenylmethan-1-ol, EINECS 202-859-9, BnOH, MFCD00004599, Hydroxymethyl resin (100-200 mesh), TOLUENE,ALPHA-HYDROXY, 4-Hydroxymethylated polystyrene, Benzyl alcohol (Benzenemethanol), NCGC00091865-01, Phenyl Methanol, Benzene-2,3,4,5,6-d5-methan-alpha,alpha-d2-ol, MBN, CAS-100-51-6, HSDB 46, Benzyl alcohol CRS, Ulesfia (TN), CCRIS 2081, Benzyl alcohol [USAN:INN:JAN], UNII-LKG8494WBH, EPA Pesticide Chemical Code 009502, Hydroxymethyl resin (200-400 mesh), BRN 0878307, enzylalcohol, phenylmethol, Benzalalcohol, Benzalcohol, Alcoolbenzylique, Benzyl?alcoho, benzene-methanol, Benzyl Alcohole, a-Hydroxytoluene, a-Toluenol, AI3-01680, Benzyl alcohol [INN:JAN:NF], Sunmorl BK 20, PhCH2OH, 185532-71-2, Bn-OH, Benzyl alcohol (Standard), SCHEMBL146, SCHEMBL147, Benzyl alcohol, ACS grade, bmse000407, C6H5CH2OH, CHEMBL720, EC 202-859-9, WLN: Q1R, BENZYL ALCOHOL [II], BENZYL ALCOHOL [MI], SCHEMBL26071, SCHEMBL41215, SCHEMBL41216, Benzyl alcohol (JP15/NF), BENZYL ALCOHOL [FCC], BENZYL ALCOHOL [INN], BENZYL ALCOHOL [JAN], 4-06-00-02222 (Beilstein Handbook Reference), BENZYL ALCOHOL (TECH), BENZYL ALCOHOL [FHFI], BENZYL ALCOHOL [HSDB], BIDD:ER0248, SCHEMBL232800, SCHEMBL487834, ALCOHOL,BENZYL [VANDF], BENZYL ALCOHOL [VANDF], Benzyl alcohol; Benzenemethanol, orb1310339, orb3025867, SCHEMBL1235190, SCHEMBL1359725, SCHEMBL4285823, SCHEMBL4626842, SCHEMBL8063620, SCHEMBL8745123, TB 13G, BENZYL ALCOHOL [MART.], Benzyl alcohol, LR, >=99%, BENZYL ALCOHOL [USP-RS], BENZYL ALCOHOL [WHO-DD], BENZYL ALCOHOL [WHO-IP], BDBM16418, HY-B0892R, MSK3302, NSC8044, Benzyl alcohol (JP18/NF/INN), HMS3264B16, HMS3885F10, HMS5083H19, Pharmakon1600-01502555, Benzyl alcohol, analytical standard, Benzyl alcohol, AR, >=99.5%, BIA74095, HY-B0892, Benzyl alcohol, anhydrous, 99.8%, Tox21_111172, Tox21_202447, Tox21_300044, BBL011938, BENZYL ALCOHOL [ORANGE BOOK], EBC-26043, NSC760098, s4600, SBB058558, STL163453, BENZYL ALCOHOL [EP MONOGRAPH], Benzyl alcohol, >=99%, FCC, FG, AKOS000119907, Benzyl alcohol, natural, >=98%, FG, CCG-213843, DB06770, NSC-760098, NCGC00091865-02, NCGC00091865-03, NCGC00091865-04, NCGC00254154-01, NCGC00259996-01, ALCOHOL BENZYLICUS [WHO-IP LATIN], Benzyl alcohol, ACS reagent, >=99.0%, Benzyl alcohol, ReagentPlus(R), >=99%, Benzyl alcohol, USP, 98.0-100.5%, BP-14106, DA-61590, FH111609, FH111704, B2378, Benzyl alcohol, tested according to Ph.Eur., Benzylalcohol 100 microg/mL in Acetonitrile, E1519, NS00009775, ST51028320, T0732, Benzyl alcohol(Discontinued,See C4X-25271), Benzyl alcohol, p.a., ACS reagent, 99.0%, Benzyl alcohol, SAJ first grade, >=98.5%, EN300-20016, Benzyl alcohol, SAJ special grade, >=99.0%, Benzyl alcohol, Vetec(TM) reagent grade, 98%, C00556, C03485, D00077, D70182, Q52353, SBI-0653497.0001, AB01563201_01, Benzene-2,3,4,5,6-d5-methan-|A,|A-d2-ol, Benzylalcohol; Benzalkonium Chloride EP Impurity A, F094986, SR-01000872610, SR-01000872610-3, BENZALKONIUM CHLORIDE IMPURITY A [EP IMPURITY], BRD-K98494274-001-03-6, BRD-K98494274-001-05-1, Benzalkonium chloride solution Impurity A [EP IMPURITY], F0001-0019, Z104476418, 3762963D-6C2A-4BFF-AD94-3180E51BCA68, Benzyl alcohol, certified reference material, TraceCERT(R), Benzyl Alcohol Working Standard (Secondary Reference Standard), Benzyl alcohol, European Pharmacopoeia (EP) Reference Standard, Benzyl alcohol, puriss. p.a., ACS reagent, >=99.0% (GC), Benzyl alcohol, United States Pharmacopeia (USP) Reference Standard, InChI=1/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H, Benzyl alcohol, Pharmaceutical Secondary Standard; Certified Reference Material, 27134-46-9, Benzyl alcohol, puriss., meets analytical specification of Ph.??Eur., BP, NF, 99-100.5% (GC), StratoSpheres(TM) PL-HMS (Hydroxymethylstyrene) resin, 50-100 mesh, extent of labeling: 2.0 mmol loading, 1 % cross-linked
Theoretical properties:
molecular_formula: C7H8O
molecular_weight: 108.14 g/mol
exact_mass: 108.057514874 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 1
heavy_atom_count: 8
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Water-white liquid
color: Water-white liquid
odor: Faint aromatic odor
boiling_point: 401 °F at 760 mmHg (NTP, 1992)
melting_point: 4.5 °F (NTP, 1992)
density: 1.05 at 1515 °F (USCG, 1999) - Denser than water; will sink
solubility: 10 to 50 mg/mL at 70 °F (NTP, 1992)
flash_point: 213 °F (NTP, 1992)
vapor_pressure: 0.1 mmHg at 68 °F ; 1 mmHg at 136 °F (NTP, 1992)
Descriptions:
pubchem: Benzyl alcohol is an aromatic alcohol that consists of benzene bearing a single hydroxymethyl substituent. It has a role as an antioxidant, a metabolite, a solvent and a fragrance.
chebi: An aromatic alcohol that consists of benzene bearing a single hydroxymethyl substituent.
chembl: BENZYL ALCOHOL is a small molecule listed in the ChEMBL database and has reached clinical trial phase 4.0.
wikipedia: Benzyl alcohol (also known as α-cresol) is an aromatic alcohol with the formula C6H5CH2OH. The benzyl group is often abbreviated "Bn" (not to be confused with "Bz" which is used for benzoyl), thus benzyl alcohol is denoted as BnOH.  Benzyl alcohol is a colorless liquid with a mild pleasant aromatic odor. It is useful as a solvent for its polarity, low toxicity, and low vapor pressure. Benzyl alcohol has moderate solubility in water (4 g/100 mL) and is miscible in alcohols and diethyl ether. The anion produced by deprotonation of the alcohol group is known as benzylate or benzyloxide.