| 2D Structure | |
| CID | 62374 |
| Target | NR1I2 |
| IUPAC Name | 2,6,6-trimethylcyclohex-2-ene-1,4-dione |
| InChI | InChI=1S/C9H12O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4H,5H2,1-3H3 |
| InChI Key | AYJXHIDNNLJQDT-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CC(=O)CC(C1=O)(C)C |
| Isomeric SMILES | CC1=CC(=O)CC(C1=O)(C)C |
| Molecular Formula | C9H12O2 |
| Molecular Weight | 152.19 |
| synonyms | ['1125-21-9', 'Ketoisophorone', '2,6,6-Trimethyl-2-cyclohexene-1,4-dione', '4-Oxoisophorone', '2,6,6-Trimethylcyclohex-2-ene-1,4-dione', '2-CYCLOHEXENE-1,4-DIONE, 2,6,6-TRIMETHYL-', 'UNII-72WY3KLB5R', 'EINECS 214-406-2', '72WY3KLB5R', 'DTXSID9021685', 'DTXCID701685', 'FEMA 3421', 'EC 214-406-2', '2,2,6-trimethylcyclohex-2-en-1,4-dione', '2-cyclohexene-1,4-dione, 2,6,6-trimethyl', '2,2,6-Trimethyl-2-cyclohexene-1,4-dione (cetoisophorone)', '2,6,6-TRIMETHYLCYCLOHEX-2-ENE-1,4-DIONE [FHFI]', '2,2,6-Trimethylcyclohex-2-en-1,4-dione (4-oxo-isophorone)', '2,6,6-Trimethy-2-cyclohexene-1,4-dione (4-oxoisophorone)', 'OIP cpd', 'TMEC-E-D', '214-406-2', 'ayjxhidnnljqdt-uhfffaoysa-n', 'inchi=1/c9h12o2/c1-6-4-7(10)5-9(2,3)8(6)11/h4h,5h2,1-3h', '4-Ketoisophorone', 'Oxopholone', 'keto-Isophorone', 'Oxophorone', '6-Oxoisophorone', '4-Oxo-alpha-isophorone', 'FEMA No. 3421', 'Oxoisophorone', '3,5,5-Trimethyl-2-cyclohexene-1,4-dione', '2,6,6-Trimethyl-2-cyclohexen-1,4-dione', 'MFCD00043119', '3,5,5-Trimethylcyclohex-2-en-1,4-dione', '3,5,5-trimethylcyclohex-2-ene-1,4-dione', '2-Cyclohexen-1,4-dione, 2,6,6-trimethyl', '4-Oxo-.alpha.-isophorone', 'SCHEMBL444616', '4-Oxoisophorone, >=98%, FG', 'CHEBI:179251', 'Tox21_201193', 'BBL027987', 's3991', 'STK801843', 'AKOS005622552', 'CCG-266233', 'NCGC00248952-01', 'NCGC00258745-01', 'AS-14431', 'SY049954', '2,6,6-trimethylcyclohex-2-en-1,4-dione', '2,6,6-trimethylcyclohex-2-ene-1,4-dion', 'CAS-1125-21-9', 'DB-003240', 'HY-107832', '2,2,6-Trimethyl-cyclohex-5-en-1,4-dione', '2,6,6-trimethyl-cyclohex-2-ene-1,4-dione', '3,5,5-trimethyl-cyclohex-2-en-1,4-dione', 'CS-0030708', 'K0034', 'NS00010663', 'EN300-198525', 'F12784', '2,6,6-Trimethyl-2-cyclohexene-1,4-dione, 98%', 'Q1490748', 'Z1255438584', '2,6,6-Trimethyl-2-cyclohexene-1,4-dione, analytical standard'] |
From Pubchem