| 2D Structure | |
| CID | 5367706 |
| Target | HDAC9 , LOC116160065 , RARA |
| IUPAC Name | [(Z)-hex-3-enyl] benzoate |
| InChI | InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3- |
| InChI Key | BCOXBEHFBZOJJZ-ARJAWSKDSA-N |
| Canonical SMILES | CCC=CCCOC(=O)C1=CC=CC=C1 |
| Isomeric SMILES | CC/C=C\CCOC(=O)C1=CC=CC=C1 |
| Molecular Formula | C13H16O2 |
| Molecular Weight | 204.26 |
| synonyms | ['cis-3-Hexenyl benzoate', '25152-85-6', '(3Z)-Hex-3-en-1-yl benzoate', 'FEMA No. 3688', '(Z)-3-Hexenyl benzoate', '3-Hexenyl benzoate, (Z)-', '3-Hexen-1-ol, benzoate, (Z)-', '3-Hexenyl benzoate, cis-', '3-Hexen-1-ol, 1-benzoate, (3Z)-', '(Z)-Hex-3-enyl benzoate', '3-Hexenyl benzoate, (3Z)-', 'EINECS 246-669-4', 'DTXSID3047554', 'AI3-35958', 'P4871S0YA9', 'BENZOIC ACID, 3-HEXENYL ESTER, (Z)-', 'DTXCID1027554', '3-Hexen-1-ol, benzoate, (3Z)-', '3-Hexen-1-ol, benzoate, (Z)-(8CI,9CI)', '(Z)-Hex-3-en-1-yl benzoate', '[(Z)-hex-3-enyl] benzoate', 'Benzoic Acid cis-3-Hexen-1-yl Ester', '(3Z)-3-Hexenyl benzoate', 'cis-3-Hexen-1-yl Benzoate', '(z)-3-hexen-1-yl benzoate', 'UNII-P4871S0YA9', 'MFCD00036526', '3Z-Hexenyl Benzoate', 'cis-Hexenyl-3-benzoate', '3-Hexen-1-ol benzoate', 'Hex-3(Z)-enyl benzoate', 'cis-3-HEXENYLBENZOATE', '[(Z)-hex-3-enyl]benzoate', 'Z-Hex-3-en-1-yl benzoate', 'SCHEMBL130434', '(3Z)-3-Hexenyl benzoate #', '(Z)-3-Hexen-1-ol benzoate', '(Z)-3-Hexen-1-yl-benzoate', 'CHEMBL3182851', 'BCOXBEHFBZOJJZ-ARJAWSKDSA-', 'FEMA 3688', 'Benzoic acid cis-3-hexenyl ester', '3-Hexenyl ester(Z)-Benzoic acid', 'CHEBI:156235', 'Tox21_302663', 'AKOS027320426', 'NCGC00256635-01', 'AS-60781', 'CAS-25152-85-6', 'B1039', 'NS00012571', 'D88740', 'cis-3-Hexenyl benzoate, >=97%, stabilized, FG', 'Q27286127', 'InChI=1/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3-'] |
From Pubchem