Compound: Terpinen-4-ol
SMILES: OC1(C(C)C)CC=C(C)CC1
InChIKey: WRYLYDPHFGVWKC-UHFFFAOYSA-N
Synonyms: Terpinen-4-ol, 4-Carvomenthenol, 562-74-3, 4-Terpineol, 1-Terpinen-4-ol, Terpinenol-4, 1-p-Menthen-4-ol, Terpene-4-ol, 1-Menthene-4-ol, TERPINENE-4-OL, 3-Cyclohexen-1-ol, 4-methyl-1-(1-methylethyl)-, 1-para-Menthen-4-ol, 4-Methyl-1-(propan-2-yl)cyclohex-3-en-1-ol, (+-)-p-Menth-1-en-4-ol, Melaleucol, 4-Methyl-1-isopropyl-3-cyclohexen-1-ol, FEMA No. 2248, para-Menth-1-en-4-ol, 1-Methyl-4-isopropyl-1-cyclohexen-4-ol, L65MV77ZG6, NSC-147749, CHEBI:78884, RefChem:25997, 4-TERPINEOL, (A+-)-, 209-235-5, 248-910-9, p-Menth-1-en-4-ol, rac Terpinen-4-ol, 4-Methyl-1-(1-methylethyl)-3-cyclohexen-1-ol, (+/-)-Terpinen-4-ol, Terpineol-4, Terpinine-4-ol, (+/-)-4-Terpineol, 1-isopropyl-4-methylcyclohex-3-en-1-ol, 4-methyl-1-propan-2-ylcyclohex-3-en-1-ol, MFCD00001562, Terpin-4-en-1-ol, (+/-)-1-Isopropyl-4-methyl-3-cyclohexen-1-ol, 1-isopropyl-4-methyl-cyclohex-3-en-1-ol, DTXSID4044824, 4-TERPINEOL, (+/-)-, 4-Terpinenol, L-4-terpineneol, Terpinenolu-4 [Czech], Terpinenolu-4, dl-4-Terpineol, 4-Carvomenthenol (natural), Terpin-4-ol, NSC 147749, CCRIS 9067, 4-methyl-1-(methylethyl)cyclohex-3-en-1-ol, 4-methyl-1-[1-methylethyl]-3-cyclohexen-1-ol, EINECS 209-235-5, EINECS 248-910-9, BRN 1906603, UNII-L65MV77ZG6, Origanol, (-)-Terpinen-4-ol (contains 30% (+)-Terpinen-4-ol at maximum), terpineol-4-ol, terrinen-4-ol, Terpinen 4-ol, rac-Terpinen-4-ol, 1-isopropyl-4-methylcyclohex-3-enol, alpha-terpinen-4-ol, (-)-1-Isopropyl-4-methyl-3-cyclohexen-1-ol, alpha -Terpinen-4-ol, 1-Isopropyl-4-methyl-3-cyclohexen-1-ol, 1-Isopropyl-4-methyl-3-cyclohexen-1-ol, (R)-, MELAFRESH T96, Terpinen-4-ol (Standard), (1)-1-(Isopropyl)-4-methylcyclohex-3-en-1-ol, SCHEMBL22344, 4-06-00-00250 (Beilstein Handbook Reference), TERPINEN-4-OL [FCC], (-)-p-Menth-1-en-4-ol, CHEMBL507795, orb1297191, 4-CARVOMENTHENOL [FHFI], DTXCID2024824, FEMA 2248, HSDB 8264, (+/-)-p-Menth-1-en-4-ol, HMS5085A08, HY-W017316R, TERPINEN-4-OL,(+/-)-, Tox21_301785, AC1341, MSK001623, NSC147749, s6118, SBB071495, AKOS015903412, CS-W018032, DB12816, EBC-615998, FT27574, HY-W017316, MSK001623-100M, SB44714, 4-Carvomenthenol, >=95%, FCC, FG, NCGC00256250-01, 4-Carvomenthenol, natural, >=95%, FG, AS-56462, CAS-562-74-3, DA-58415, ST096089, SY012857, cyclohexen-4-ol, 1-methyl-4-isopropyl-1-, DB-066063, DB-234185, M0319, NS00013199, T1993, 4-methyl-1-(methylethyl)-3-cyclohexen-1-ol, C17073, 4-methyl-l-(1-methylethyl)-3-cyclohexaen-1-ol, 3-cyclohexen-1-ol, 4-methyl-1-[1-methylethyl], 3-cyclohexen-1-ol,4-methyl-1-(1-methylethyl)-, Q416114, (-)-4-Hydroxy-4-isopropyl-1-methyl-1-cyclohexene, 1-(ISOPROPYL)-4-METHYLCYCLOHEX-3-EN-1-OL, rac Terpinen-4-ol Solution in Methanol, 100ug/mL, (+/-)-4-Hydroxy-4-isopropyl-1-methyl-1-cyclohexene, METHYL-1-(1-METHYLETHYL)-3-CYCLOHEXEN-1-OL, Terpinen 4-ol, primary pharmaceutical reference standard
Theoretical properties:
molecular_formula: C10H18O
molecular_weight: 154.25 g/mol
exact_mass: 154.135765193 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 1
heavy_atom_count: 11
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Colorless to pale yellow liquid
color: Colorless to pale yellow liquid
odor: Pine
boiling_point: 209 °C
density: 0.926 g/cu cm at 20 °C
solubility: Slightly soluble in water, soluble in oils
flash_point: 79 degrees C (174  degrees F) - closed cup
Descriptions:
pubchem: 4-terpineol is a terpineol that is 1-menthene carrying a hydroxy substituent at position 4. It has a role as an antioxidant, a volatile oil component, an antibacterial agent, an antiparasitic agent, an antineoplastic agent, an anti-inflammatory agent, an apoptosis inducer and a plant metabolite. It is a terpineol and a tertiary alcohol.
chebi: A terpineol that is 1-menthene carrying a hydroxy substituent at position 4.
chembl: TERPINEOL is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Terpinen-4-ol is an isomer of terpineol with the chemical formula C10H18O. A primary constituent of tea tree oil, it is obtained as an extract from the leaves, branches, and bark of Melaleuca alternifolia Cheel. Despite considerable basic and preliminary clinical research of terpinen-4-ol and tea tree oil, its biological properties and potential for clinical uses have not been established as of 2019. It may be a factor in the contact dermatitis of tea tree oil when used topically.
Terpinen-4-ol occurs in Juniperus communis and is thought to be the reason why this wood is highly resistant to rot.