Compound: 2-PHENYLETHANOL
SMILES: OCCc1ccccc1
InChIKey: WRMNZCZEMHIOCP-UHFFFAOYSA-N
Synonyms: 2-PHENYLETHANOL, Phenethyl alcohol, 60-12-8, Phenylethyl alcohol, Benzeneethanol, Phenylethanol, Phenethanol, 2-Phenylethyl alcohol, beta-Phenylethanol, Benzylcarbinol, beta-Phenylethyl alcohol, 2-Hydroxyethylbenzene, Ethanol, 2-phenyl-, FEMA No. 2858, beta-PEA, 2-PEA, beta-Hydroxyethylbenzene, beta-Fenylethanol, DTXSID9026342, NSC-406252, ML9LGA7468, Phenylethyl alcohol (USP), Phenylethyl alcohol [USP], DTXCID206342, CHEBI:49000, NSC406252, 2 Phenylethanol, Carbinol, Benzyl, beta Phenylethanol, Alcohol, Phenethyl, Alcohol, Phenylethyl, METHANOL, BENZYL, RefChem:44427, beta-(HYDROXYETHYL)BENZENE, 200-456-2, Benzyl carbinol, 2-Phenylethan-1-Ol, 2-PHENYL-ETHANOL, 2-Phenethyl alcohol, Benzylmethanol, Phenyl ethyl alcohol, Methanol, benzyl-, Benzenethanol, Phenethylalcohol, 1-Phenyl-2-ethanol, 2-Phenethanol, 1321-27-3, beta-Phenethyl alcohol, MFCD00002886, .beta.-Hydroxyethylbenzene, .beta.-Phenylethyl alcohol, Hydroxyethylbenzene, .beta.-Phenylethanol, 2-phenyl-1-ethanol, .beta.-PEA, .beta.-Phenethyl alcohol, .beta.-(hydroxyethyl)benzene, NCGC00166215-02, Caswell No. 655C, FEMA Number 2858, beta-Fenylethanol [Czech], 2-phenyl ethanol, CAS-60-12-8, Phenethyl alcohol (natural), beta-Fenethylalkohol [Czech], beta-Fenethylalkohol, PEL, SMR000059156, HSDB 5002, EINECS 200-456-2, EPA Pesticide Chemical Code 001503, NSC 406252, BRN 1905732, UNII-ML9LGA7468, benzene-ethanol, Mellol, phenyl-ethanol, Benzyl-Methanol, AI3-00744, 2-PhenyIethanol, phenylethyl-alcohol, .beta.-Phenethanol, .beta.-Fenylethanol, b-Hydroxyethylbenzene, Benzyl ethyl alcohol, Benzeneethanol, 9CI, betaphenylethyl alcohol, .beta.-Fenethylalkohol, 2-Phenylethanol, USP, A-PEA, (2-Hydroxyethyl)benzene, beta -hydroxyethylbenzene, 2-Phenylethanol, 99%, .beta.-P.E.A., Phenylethyl alcohol, USAN, bmse000659, Phenylethyl, beta- alcohol, EC 200-456-2, 2-(2-Hydroxyethyl)benzene, SCHEMBL1837, SCHEMBL1838, WLN: Q2R, 2-Phenylethanol (Standard), Sodium Valproate Impurity M, 4-06-00-03067 (Beilstein Handbook Reference), MLS001066349, MLS001336026, SCHEMBL241799, SCHEMBL310013, SCHEMBL321365, SCHEMBL398335, SCHEMBL443761, PHENETHYL ALCOHOL [MI], Phenethyl alcohol, 8CI, BAN, CHEMBL448500, orb1311023, orb3026042, SCHEMBL1167334, SCHEMBL7449425, SCHEMBL8571518, PHENETHYL ALCOHOL [FCC], PHENYLETHYL, B- ALCOHOL, PHENYLETHYL ALCOHOL [II], SCHEMBL11611810, SCHEMBL14354468, SCHEMBL23521496, BDBM85807, FEMA 2858, HY-B1290R, PHENETHYL ALCOHOL [MART.], HMS2093H05, HMS2233H06, HMS3374P04, HMS5081D22, Pharmakon1600-01505398, PHENYLETHYL ALCOHOL [FHFI], PHENYLETHYL ALCOHOL [HSDB], PHENETHYL ALCOHOL [WHO-DD], CS-B1821, HY-B1290, NSC_6054, Tox21_113544, Tox21_201322, Tox21_303383, BBL036905, EBC-04277, MSK000760, NSC759116, PHENYLETHYL ALCOHOL [USP-RS], s3703, SBB040879, STL281950, 2-Phenylethanol, >=99.0% (GC), AKOS000249688, Tox21_113544_1, CCG-213419, DB02192, FP16235, MSK000760-100M, NSC-759116, CAS_60-12-8, Phenethyl alcohol, >=99%, FCC, FG, MSK000760-1000M, NCGC00166215-01, NCGC00166215-03, NCGC00166215-04, NCGC00166215-05, NCGC00257347-01, NCGC00258874-01, AC-18484, PHENYLETHYL ALCOHOL [USP MONOGRAPH], SBI-0206858.P001, NS00004212, P0084, ST50214476, EN300-19347, C05853, D00192, D70868, Phenethyl alcohol, natural, >=99%, FCC, FG, AB00698274_05, F222397, Phenethyl alcohol Solution in Methanol, 100ug/mL, Q209463, SR-01000763553, Phenethyl alcohol Solution in Methanol, 1000ug/mL, SR-01000763553-2, 0DE4CADC-AB8A-4038-BD6F-EBD009885652, BRD-K42371134-001-06-6, F0001-1575, Z104473586, 2-phenylethanol;2-Phenylethyl alcohol;Benzeneethanol;Phenylethanol, InChI=1/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H, Phenylethyl alcohol, United States Pharmacopeia (USP) Reference Standard, Phenylethyl Alcohol, Pharmaceutical Secondary Standard; Certified Reference Material, 19601-20-8
Theoretical properties:
molecular_formula: C8H10O
molecular_weight: 122.16 g/mol
exact_mass: 122.073164938 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 2
heavy_atom_count: 9
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: COLORLESS, VISCOUS LIQUID
color: COLORLESS, VISCOUS LIQUID
odor: CHARACTERISTIC ROSE-LIKE ODOR
density: 1.0202 AT 20 °C/4 °C
flash_point: 102 °C
vapor_pressure: 0.08 [mmHg]
Descriptions:
pubchem: 2-phenylethanol is a primary alcohol that is ethanol substituted by a phenyl group at position 2. It has a role as a plant growth retardant, a fragrance, a Saccharomyces cerevisiae metabolite, a plant metabolite and an Aspergillus metabolite. It is a primary alcohol and a member of benzenes.
chebi: A primary alcohol that is ethanol substituted by a phenyl group at position 2.
chembl: PHENYLETHYL ALCOHOL is a small molecule listed in the ChEMBL database and has reached clinical trial phase -1.0.
wikipedia: Phenethyl alcohol, or 2-phenylethanol, is an organic compound with the chemical formula C8H10O or C6H5CH2CH2OH. It is a colourless liquid with a pleasant floral odor. It occurs widely in nature, being found in a variety of essential oils. It is slightly soluble in water (2 ml per 100 ml of H2O), but miscible with most organic solvents. The molecule of phenethyl alcohol consists of a phenethyl group (C6H5CH2CH2−) attached to a hydroxyl group (−OH).