Dimethyl butylmalonate
dimethyl 2-butylpropanedioate
Also Known As: Dimethyl butylmalonate|Dimethylbutylmalonate|dimethyl 2-butylpropanedioate|Pregabalin Impurity 94|Dimethyl 2-butylmalonate|Dimethyl butylpropanedioate|Butylmalonsaeuredimethylester|Dimethyl 2-butylmalonate #|Butylmalonic acid dimethyl ester|EINECS 254-489-2|1,3-dimethyl 2-butylpropanedioate|Jsp006860|dimethyl 2-butylpropane-1,3-dioate|Propanedioic acid, 2-butyl-, 1,3-dimethyl ester|Propanedioic acid, butyl-, dimethyl ester|Pentane-1,1-dicarboxylic acid dimethyl ester|520D224|Ehyl 8-methoxy-4-(o-tolylamino)quinoline-3-carboxylate
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10486 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.10486 |
| Monoisotopic Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 517-63-5 |
|---|---|
| SMILES | CCCCC(C(=O)OC)C(=O)OC |
| InChIKey | UVCBPUQNMGFVAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl butylmalonate (CAS 517-63-5), with molecular formula C9H16O4 and molecular weight 188.10486 g/mol. IUPAC: dimethyl 2-butylpropanedioate.
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