2-Isobutylsuccinic acid
2-(2-methylpropyl)butanedioic acid
Also Known As: 2-(2-methylpropyl)butanedioic Acid|2-isobutylsuccinic acid|Pregabalin Diacid|isobutylsuccinic acid|Pregabalin Diacid Impurity|Succinic acid, isobutyl-|Isobutylbernsteinsaure|Pregabalin Impurity 27|2-ISOBUTYL SUCCINIC ACID|2-isobutylbutanedioic acid|Butanedioic acid, 2-(2-methylpropyl)-|Pregabalin Isobutyl succinic Acid|2-(2-methylpropyl)butanedioicAcid|2-(2-methylpropyl)-butanedioic acid|J1.739.055D|2-(2-Methylpropyl)-butanedioic Acid (Pregabalin Impurity|3-Carboxy-5-methylhexanoic acid; 2-isobutylsuccinic acid; Pregabalin related impurity|840-863-8|Butanedioic acid, 2-(2-methylpropyl)-; Butanedioic acid, (2-methylpropyl)- (9CI); Succinic acid, isobutyl- (7CI,8CI); 2-(2-Methylpropyl)butanedioic acid; 1,2-Pentanedicarboxylic acid, 4-methyl-
| Molecular Formula | C8H14O4 |
|---|---|
| Molecular Weight | 174.0892 g/mol |
| LogP | 1.208 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 174.0892 |
| Monoisotopic Mass | 174.0892 |
| Heavy Atoms | 12 |
| Complexity | 173.89667 |
Chemical Identifiers
| CAS Number | 5702-99-8 |
|---|---|
| SMILES | CC(C)CC(CC(=O)O)C(=O)O |
Product Overview
2-Isobutylsuccinic acid (CAS 5702-99-8), with molecular formula C8H14O4 and molecular weight 174.0892 g/mol. IUPAC: 2-(2-methylpropyl)butanedioic acid.
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