2-Isopentyl-1,3-cyclopentanedione
2-(3-methylbutyl)cyclopentane-1,3-dione
Also Known As: 2-Isopentyl-1,3-cyclopentanedione|1,3-Cyclopentanedione, 2-isopentyl-|2-isopentylcyclopentane-1,3-dione|2-(3-methylbutyl)cyclopentane-1,3-dione|1,3-Cyclopentanedione,2-isopentyl-|2-(3-Methylbutyl)-1,3-cyclopentanedione
CAS: 827-03-2
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.11504 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.11504 |
| Monoisotopic Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 827-03-2 |
|---|---|
| SMILES | CC(C)CCC1C(=O)CCC1=O |
| InChIKey | TYOWQTJGWOMCML-UHFFFAOYSA-N |
Product Overview
2-Isopentyl-1,3-cyclopentanedione (CAS 827-03-2), with molecular formula C10H16O2 and molecular weight 168.11504 g/mol. IUPAC: 2-(3-methylbutyl)cyclopentane-1,3-dione.
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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