4-Oxo-4-(2,4,6-trimethylphenyl)but-2-enoic acid
4-oxo-4-(2,4,6-trimethylphenyl)but-2-enoic acid
Also Known As: 4-oxo-4-(2,4,6-trimethylphenyl)but-2-enoic acid|(2E)-4-mesityl-4-oxo-2-butenoic acid|2-Butenoic acid,4-oxo-4-(2,4,6-trimethylphenyl)-, (2E)-
CAS: 6313-01-5
| Molecular Formula | C13H14O3 |
|---|---|
| Molecular Weight | 218.0943 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.0943 |
| Monoisotopic Mass | 218.0943 |
| Heavy Atoms | 16 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 6313-01-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C(=O)C=CC(=O)O)C |
| InChIKey | YZAVQWHPGAFDIH-UHFFFAOYSA-N |
Product Overview
4-Oxo-4-(2,4,6-trimethylphenyl)but-2-enoic acid (CAS 6313-01-5), with molecular formula C13H14O3 and molecular weight 218.0943 g/mol. IUPAC: 4-oxo-4-(2,4,6-trimethylphenyl)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.
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4-Oxo-4-(2,4,6-trimethylphenyl)but-2-enoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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