Linalyl isobutyrate
3,7-dimethylocta-1,6-dien-3-yl 2-methylpropanoate
CAS: 78-35-3
| Molecular Formula | C14H24O2 |
|---|---|
| Molecular Weight | 224.34 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 224.17763 |
| Heavy Atoms | 16 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 78-35-3 |
|---|---|
| SMILES | CC(C)C(=O)OC(C)(CCC=C(C)C)C=C |
| InChIKey | JZIARAQCPRDGAC-UHFFFAOYSA-N |
📖 Product Overview
Linalyl isobutyrate (CAS: 78-35-3) is a chemical compound with molecular formula C14H24O2 and molecular weight 224.34 g/mol. Its IUPAC systematic name is 3,7-dimethylocta-1,6-dien-3-yl 2-methylpropanoate.
JZIARAQCPRDGAC-UHFFFAOYSA-N.
SMILES: CC(C)C(=O)OC(C)(CCC=C(C)C)C=C.
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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📚 Academic Support
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