4-Oxo-4-(4-propan-2-ylphenyl)but-2-enoic acid
4-oxo-4-(4-propan-2-ylphenyl)but-2-enoic acid
Also Known As: 3-(4-Isopropylbenzoyl)acrylic acid|KS-00003NHA|3-(4-iso-Propylbenzoyl)acrylic acid|4-oxo-4-(4-propan-2-ylphenyl)but-2-enoic Acid|4-(4-Isopropyl-phenyl)-4-oxo-but-2-enoic acid
CAS: 29587-82-4
| Molecular Formula | C13H14O3 |
|---|---|
| Molecular Weight | 218.0943 g/mol |
| LogP | 2.6335 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.0943 |
| Monoisotopic Mass | 218.0943 |
| Heavy Atoms | 16 |
| Complexity | 413.30878 |
Chemical Identifiers
| CAS Number | 29587-82-4 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C(=O)C=CC(=O)O |
Product Overview
4-Oxo-4-(4-propan-2-ylphenyl)but-2-enoic acid (CAS 29587-82-4), with molecular formula C13H14O3 and molecular weight 218.0943 g/mol. IUPAC: 4-oxo-4-(4-propan-2-ylphenyl)but-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 →
4-Oxo-4-(4-propan-2-ylphenyl)but-2-enoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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