(2E)-4-(4-Bromophenyl)-4-oxo-2-butenoic acid
(E)-4-(4-bromophenyl)-4-oxobut-2-enoic acid
Also Known As: 3-(4-Bromobenzoyl)acrylic acid|(2E)-4-(4-bromophenyl)-4-oxobut-2-enoic acid|(E)-4-(4-bromophenyl)-4-oxobut-2-enoic acid|(E)-3-(4-Bromobenzoyl)acrylic acid|3-(4-BROMOBENZOYL)ACRYLICACID|3-(4-methylbenzoyl)acrylic acid|(2E)-4-(4-bromophenyl)-4-oxo-2-butenoic acid|3-(4-Bromobenzoyl)-acrylic acid|4-(4-bromophenyl)-4-oxobut-2-enoic acid|2-Butenoic acid, 4-(4-bromophenyl)-4-oxo-, (E)-|(2E)-3-(4-Bromobenzoyl)acrylic acid|4-(4-Bromophenyl)-4-oxo-2-butenoic acid|Butanoic acid,2-(3,5-dichlorophenoxy)|NCGC00340477-01|4-Oxo-4-(4-bromophenyl)-2-butenoic acid|BB 0218779|2-Butenoic acid, 4-(4-bromophenyl)-4-oxo-|J1.394.201C|J2.821.577K|(E)-4-(4-Bromophenyl)-4-oxobut-2-enoicacid|2-butenoic acid, 4-(4-bromophenyl)-4-oxo-, (2E)-|AB01333480-02|(E)-4-(4-bromophenyl)-4-oxo-but-2-enoic acid
| Molecular Formula | C10H7BrO3 |
|---|---|
| Molecular Weight | 253.95786 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.95786 |
| Monoisotopic Mass | 253.95786 |
| Heavy Atoms | 14 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 39644-80-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)/C=C/C(=O)O)Br |
| InChIKey | CJNVLFPUEBQQMZ-AATRIKPKSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2E)-4-(4-Bromophenyl)-4-oxo-2-butenoic acid (CAS 39644-80-9), with molecular formula C10H7BrO3 and molecular weight 253.95786 g/mol. IUPAC: (E)-4-(4-bromophenyl)-4-oxobut-2-enoic acid.