Butanoic acid, 3-oxo-, 2-(acetyloxy)ethyl ester
2-acetyloxyethyl 3-oxobutanoate
Also Known As: 2-Acetoxyethyl acetoacetate|2-Acetoxyethyl acetylacetate|2-acetyloxyethyl 3-oxobutanoate|2-(acetyloxy)ethyl 3-oxobutanoate|2-acetoxyethyl 3-oxobutanoate|Acetoacetic acid, 2-acetoxyethyl ester|3-Oxobutanoic acid 2-(acetyloxy)ethyl ester|Butanoic acid, 3-oxo-, 2-(acetyloxy)ethyl ester|3-Oxobutanoicacid2- ethylester|AAEM Resin(Acetoacetoxyethyl Ketoester Resin)|4-03-00-01543 (Beilstein Handbook Reference)|AAEM Resin (Acetoacetoxyethyl Ketoester Resin)
| Molecular Formula | C8H12O5 |
|---|---|
| Molecular Weight | 188.06847 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.06847 |
| Monoisotopic Mass | 188.06847 |
| Heavy Atoms | 13 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 5331-30-6 |
|---|---|
| SMILES | CC(=O)CC(=O)OCCOC(=O)C |
| InChIKey | NGAVSCAXDJMZQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanoic acid, 3-oxo-, 2-(acetyloxy)ethyl ester (CAS 5331-30-6), with molecular formula C8H12O5 and molecular weight 188.06847 g/mol. IUPAC: 2-acetyloxyethyl 3-oxobutanoate.