2-Butenoic acid, 2(or 3)-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester
3,7-dimethylocta-2,6-dienyl 2-methylbut-2-enoate
Also Known As: Geranyl tiglate, Geranyltiglate, Geranium oil, Geranium oil, Chinese, Tiglic acid, geraniol ester, CTK3J7355, CTK5F2082, CTK5H4385, EINECS 282-534-6, 3,7-dimethylocta-2,6-dienyl 2-methylbut-2-enoate, (E)-3,7-Dimethyl-2,6-octadienyl 2-methylisocrotonate, (Z)-3,7-Dimethyl-2,6-octadienyl 2-methylcrotonate, 2-Butenoic acid, 2(or 3)-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester, 2-Butenoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E,E)-, 2-Butenoic acid, 2(or 3)-methyl-, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
| Molecular Formula | C15H24O2 |
|---|---|
| Molecular Weight | 236.17763 g/mol |
| LogP | 4.19 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 236.17763 |
| Heavy Atoms | 17 |
| Complexity | 328 |
Chemical Identifiers
| CAS Number | 7785-33-3 |
|---|---|
| SMILES | CC=C(C)C(=O)OCC=C(C)CCC=C(C)C |
Product Overview
2-Butenoic acid, 2(or 3)-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester (CAS 7785-33-3), with molecular formula C15H24O2 and molecular weight 236.17763 g/mol. IUPAC: 3,7-dimethylocta-2,6-dienyl 2-methylbut-2-enoate.
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