3-Ethoxy-2,2-dimethyl-3-oxopropanoic acid
3-ethoxy-2,2-dimethyl-3-oxopropanoic acid
Also Known As: 3-ethoxy-2,2-dimethyl-3-oxopropanoic acid|DIMETHYLMALONIC ACID MONOETHYL ESTER|Dimethylmalonsaureathylester|CS-M2955|CE-552|3-ethoxy-2,2-dimethyl-3-oxopropanoicacid|GS-4383|2,2-dimethylmalonic acid monoethyl ester|3-Ethoxy-2,2-dimethyl-3-oxo-propanoic acid|2,2-dimethyl-malonic acid monoethyl ester|2,3,3,4,5,6-HEXACHLOROBIPHENYL|3-ethoxy-2,2-dimethyl-3-oxopropionic acid|propanoic acid, 2-ethoxycarbonyl-2-methyl-|3-ethoxy-2,2-dimethyl-3-oxo-propionic acid|4CH-001708
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07356 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.07356 |
| Monoisotopic Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 6331-49-3 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)C(=O)O |
| InChIKey | WDWFSABLPAHCPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethoxy-2,2-dimethyl-3-oxopropanoic acid (CAS 6331-49-3), with molecular formula C7H12O4 and molecular weight 160.07356 g/mol. IUPAC: 3-ethoxy-2,2-dimethyl-3-oxopropanoic acid.