![N-[(3-Chloro-4-fluorophenyl)sulfonyl]-beta-alanine structure](/static/products/6136/613657-34-4.webp)
N-[(3-Chloro-4-fluorophenyl)sulfonyl]-beta-alanine
3-[(3-chloro-4-fluorophenyl)sulfonylamino]propanoic acid
Also Known As: 3-{[(3-chloro-4-fluorophenyl)sulfonyl]amino}propanoic acid|3-((3-chloro-4-fluorophenyl)sulfonamido)propanoic acid|3-(3-chloro-4-fluorobenzenesulfonamido)propanoic acid|NCGC00342575-01|N-[(3-chloro-4-fluorophenyl)sulfonyl]-beta-alanine|3-[(3-chloro-4-fluorophenyl)sulfonylamino]propanoic acid|b-Alanine,N-[(3-chloro-4-fluorophenyl)sulfonyl]-|AB01334739-02|F1360-0214|AF-399/41585983|3-[(3-chloro-4-fluoro-phenyl)sulfonylamino]propanoic Acid|N-((3-Chloro-4-fluorophenyl)sulfonyl)-beta-alanine|SR-01000084851-1|3-(3-chloro-4-fluorophenylsulfonamido)propanoic acid|N-(3-Chloro-4-fluorobenzene-1-sulfonyl)-beta-alanine|N-[(3-Chloro-4-fluorophenyl)sulfonyl]-I(2)-alanine|3-([(3-Chloro-4-fluorophenyl)sulfonyl]amino)propanoic acid|3-[[(3-CHLORO-4-FLUOROPHENYL)SULFONYL]AMINO]PROPANOIC ACID|(2-carboxyethylamino)-3-chloro-4-fluorophenyl(oxo)-lambda-sulfaniumolate
| Molecular Formula | C9H9ClFNO4S |
|---|---|
| Molecular Weight | 280.9925 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.9925 |
| Monoisotopic Mass | 280.9925 |
| Heavy Atoms | 17 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 613657-34-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)NCCC(=O)O)Cl)F |
| InChIKey | QWDZIHCJRBNTMS-UHFFFAOYSA-N |
Product Overview
N-[(3-Chloro-4-fluorophenyl)sulfonyl]-beta-alanine (CAS 613657-34-4), with molecular formula C9H9ClFNO4S and molecular weight 280.9925 g/mol. IUPAC: 3-[(3-chloro-4-fluorophenyl)sulfonylamino]propanoic acid.