2-Cyano-3-phenylbut-2-enoic acid
2-cyano-3-phenylbut-2-enoic acid
Also Known As: 2-cyano-3-phenylbut-2-enoic acid|2-Butenoicacid, 2-cyano-3-phenyl-
CAS: 6332-95-2
| Molecular Formula | C11H9NO2 |
|---|---|
| Molecular Weight | 187.06332 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.06332 |
| Monoisotopic Mass | 187.06332 |
| Heavy Atoms | 14 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 6332-95-2 |
|---|---|
| SMILES | CC(=C(C#N)C(=O)O)C1=CC=CC=C1 |
| InChIKey | LEHQQGAGTSMDKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (1 patents)
Photographic Chemicals (2 patents)
Specialty Chemicals (1 patents)
Product Overview
2-Cyano-3-phenylbut-2-enoic acid (CAS 6332-95-2), with molecular formula C11H9NO2 and molecular weight 187.06332 g/mol. IUPAC: 2-cyano-3-phenylbut-2-enoic 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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