2-(Butan-2-yl)butanedioic acid
2-butan-2-ylbutanedioic acid
Also Known As: 2-(butan-2-yl)butanedioic acid|2-butan-2-ylbutanedioic acid|2-(sec-Butyl)succinic acid|3-carboxy-4-methylhexanoic acid
CAS: 5653-98-5
| Molecular Formula | C8H14O4 |
|---|---|
| Molecular Weight | 174.0892 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 174.0892 |
| Monoisotopic Mass | 174.0892 |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 5653-98-5 |
|---|---|
| SMILES | CCC(C)C(CC(=O)O)C(=O)O |
| InChIKey | OKLHGPQSJDHYTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Polymer Intermediates (2 patents)
Product Overview
2-(Butan-2-yl)butanedioic acid (CAS 5653-98-5), with molecular formula C8H14O4 and molecular weight 174.0892 g/mol. IUPAC: 2-butan-2-ylbutanedioic acid.
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.
View MSDS →
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