| 2D Structure | |
| CID | 111037 |
| Target | CYP2C19 , CYP2C9 , CYP3A4 , ESR1 |
| IUPAC Name | 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl acetate |
| InChI | InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3 |
| InChI Key | IGODOXYLBBXFDW-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CCC(CC1)C(C)(C)OC(=O)C |
| Isomeric SMILES | CC1=CCC(CC1)C(C)(C)OC(=O)C |
| Molecular Formula | C12H20O2 |
| Molecular Weight | 196.29 |
| synonyms | ['ALPHA-TERPINYL ACETATE', 'p-Menth-1-en-8-yl acetate', 'p-Menth-1-en-8-ol, acetate', '2-(4-methylcyclohex-3-en-1-yl)propan-2-yl acetate', 'alpha-Terpineol acetate', 'alpha-Terpineol, acetate', '.alpha.-Terpinyl acetate', '.alpha.-Terpineol acetate', 'Terpinyl acetate (natural)', 'DTXSID2026496', 'EINECS 201-265-7', 'EINECS 234-183-5', '3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, acetate', 'BRN 3198769', 'AI3-00522', 'DTXCID506496', '3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, acetate', 'EC 201-265-7', '.ALPHA.-TERPINEOL, ACETATE', '4-06-00-00253 (Beilstein Handbook Reference)', 'alpha,alpha,4-Trimethyl-3-cyclohexene-1-methyl acetate', '3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, 1-acetate', '(1)-alpha,alpha,4-Trimethylcyclohex-3-ene-1-methyl acetate', '3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, 1-acetate', '.ALPHA.,.ALPHA.,4-TRIMETHYL-3-CYCLOHEXENE-1-METHYL ACETATE', '(+-)-alpha-Terpinyl acetate', 'ALPHA-TERPINYL ACETATE, (+-)-', 'ALPHA-TERPINYL ACETATE. (+-)-', '.ALPHA.-TERPINYL ACETATE, (+-)-', '.ALPHA.-TERPINYL ACETATE. (+-)-', '201-265-7', 'Terpinyl acetate', '80-26-2', 'Terpineol, acetate', '8007-35-0', '(+/-)-alpha-Terpinyl acetate', '9RXE0I9F2J', 'CHEBI:32320', 'Terpineol acetate', 'MFCD00037155', 'Terpinyl acetate (mixture of isomers)', '(+/-)-2-(4-Methyl-3-cyclohexenyl)isopropyl acetate', 'CAS-80-26-2', 'UNII-NIT9SZT3D7', 'UNII-9RXE0I9F2J', '1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate', 'FEMA No. 3047', '-erpinyl acetate', 'terpinenyl acetate', 'a-Terpineol acetate', 'EINECS 232-357-5', 'NIT9SZT3D7', '1-Methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl acetate #', 'SCHEMBL580624', 'CHEMBL3183581', 'FEMA 3047', 'HY-N7136R', '[1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl] acetate', '|A-?Terpinyl acetate (Standard)', 'alpha-Terpinyl acetate, (+/-)-', 'HY-N7136', 'Tox21_202188', 'Tox21_303242', 's5691', 'alpha-Terpinyl acetate, >=95%, FG', 'AKOS015964845', 'LMPR0102090045', 'NCGC00164334-01', 'NCGC00164334-02', 'NCGC00256977-01', 'NCGC00259737-01', '10581-37-0', 'MS-23062', '.ALPHA.-TERPINYL ACETATE, (+/-)-', '.ALPHA.-TERPINYL ACETATE. (+/-)-', 'CS-0099572', 'NS00001559', 'T0023', 'E80789', '2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl acetate', 'Q4456134', '2-(4-METHYL-3-CYCLOHEXEN-1-YL)-2-PROPYL ACETATE', '(+/-)-alpha-Terpinyl acetate, predominantly alpha-isomer, analytical standard', '(+/-)-alpha-Terpinyl acetate, predominantly alpha-isomer, technical, >=90% (GC)'] |
From Pubchem