3,5-Heptanedione, 4-methyl-1-nitro-
4-methyl-1-nitroheptane-3,5-dione
Also Known As: 4-methyl-1-nitroheptane-3,5-dione|3,5-Heptanedione, 4-methyl-1-nitro-|4-Methyl-1-nitro-3,5-heptanedione|4-Methyl-1-nitro-3,5-heptanedione #
CAS: 62250-63-9
| Molecular Formula | C8H13NO4 |
|---|---|
| Molecular Weight | 187.08446 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.08446 |
| Monoisotopic Mass | 187.08446 |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 62250-63-9 |
|---|---|
| SMILES | CCC(=O)C(C)C(=O)CC[N+](=O)[O-] |
| InChIKey | HVXSMBVGUWLSCW-UHFFFAOYSA-N |
Product Overview
3,5-Heptanedione, 4-methyl-1-nitro- (CAS 62250-63-9), with molecular formula C8H13NO4 and molecular weight 187.08446 g/mol. IUPAC: 4-methyl-1-nitroheptane-3,5-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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3,5-Heptanedione, 4-methyl-1-nitro- is a custom synthesis product. We offer services from milligram to kilogram scale.
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