4-((4-Fluorophenyl)amino)-4-oxo-2-butenoic acid
4-(4-fluoroanilino)-4-oxobut-2-enoic acid
Also Known As: 4-(4-fluoroanilino)-4-oxobut-2-enoic acid|KS-00003TIE|N-(4-Fluorophenyl)maleamic acid|3-[(4-fluorophenyl)carbamoyl]prop-2-enoic acid|(2E)-4-[(4-fluorophenyl)amino]-4-oxobut-2-enoic acid|(E)-4-(4-fluoroanilino)-4-oxo-but-2-enoic acid|4-(4-fluoroanilino)-4-oxo-but-2-enoic acid|4-[(4-Fluorophenyl)amino]-4-oxo-2-butenoic acid|(E)-4-(4-fluoroanilino)-4-oxobut-2-enoic acid|(Z)-4-((4-Fluorophenyl)amino)-4-oxobut-2-enoic acid|4-((4-Fluorophenyl)amino)-4-oxo-2-butenoic acid|4-((4-Fluorophenyl)amino)-4-oxobut-2-enoic acid|4-[(4-fluorophenyl)amino]-4-oxobut-2-enoic acid|(Z)-4-(4-fluorophenylamino)-4-oxobut-2-enoic acid
| Molecular Formula | C10H8FNO3 |
|---|---|
| Molecular Weight | 209.04883 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.04883 |
| Monoisotopic Mass | 209.04883 |
| Heavy Atoms | 15 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 780-05-2 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C=CC(=O)O)F |
| InChIKey | NRDZVHHPNZDWRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((4-Fluorophenyl)amino)-4-oxo-2-butenoic acid (CAS 780-05-2), with molecular formula C10H8FNO3 and molecular weight 209.04883 g/mol. IUPAC: 4-(4-fluoroanilino)-4-oxobut-2-enoic acid.