3-Isopropenyl-6-oxoheptanoic acid
6-oxo-3-prop-1-en-2-ylheptanoic acid
Also Known As: limononic acid|3-Isopropenyl-6-oxoheptanoic acid|FEMA No. 4461|Heptanoic acid, 3-isopropenyl-6-oxo-|6-oxo-3-prop-1-en-2-ylheptanoic acid|6-oxo-3-(prop-1-en-2-yl)heptanoic acid|(+/-)-3-Isopropenyl-6-oxoheptanoic acid|Heptanoic acid, 3-(1-methylethenyl)-6-oxo-|3-Isopropenyl-6-oxoheptanoic acid, (+/-)-|3-(1-Methylethenyl)-6-oxo-heptanoic acid|3-(3-Oxobutyl)-4-methyl-4-pentenoic acid|J1.014.517A|(+-)-3-ISOPROPENYL-6-OXOHEPTANOIC ACID|3-ISOPROPENYL-6-OXOHEPTANOIC ACID, (+-)-
CAS: 4436-82-2
| Molecular Formula | C10H16O3 |
|---|---|
| Molecular Weight | 184.10994 g/mol |
| LogP | 2.0226 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 184.10994 |
| Monoisotopic Mass | 184.10994 |
| Heavy Atoms | 13 |
| Complexity | 218.20975 |
Chemical Identifiers
| CAS Number | 4436-82-2 |
|---|---|
| SMILES | CC(=C)C(CCC(=O)C)CC(=O)O |
Product Overview
3-Isopropenyl-6-oxoheptanoic acid (CAS 4436-82-2), with molecular formula C10H16O3 and molecular weight 184.10994 g/mol. IUPAC: 6-oxo-3-prop-1-en-2-ylheptanoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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