Methyl 2,2-diethylacetoacetate
methyl 2,2-diethyl-3-oxobutanoate
Also Known As: Methyl 2,2-diethylacetoacetate|methyl 2,2-diethyl-3-oxobutanoate|methyl2,2-diethylacetoacetate|EINECS 285-846-0|methyl2,2-diethyl-3-oxobutanoate|2,2-Diethylacetoacetic acid methyl ester|2,2-Diethyl-3-oxobutanoic acid methyl ester|Butanoic acid, 2,2-diethyl-3-oxo-, methyl ester
CAS: 85153-63-5
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.10994 g/mol |
| LogP | 1.5548 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.10994 |
| Monoisotopic Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 180.21266 |
Chemical Identifiers
| CAS Number | 85153-63-5 |
|---|---|
| SMILES | CCC(CC)(C(=O)C)C(=O)OC |
Product Overview
Methyl 2,2-diethylacetoacetate (CAS 85153-63-5), with molecular formula C9H16O3 and molecular weight 172.10994 g/mol. IUPAC: methyl 2,2-diethyl-3-oxobutanoate.
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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