3-[4-[(4-Chlorophenyl)thio]-3-nitrophenyl]acrylic acid
3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]prop-2-enoic acid
Also Known As: 3-[4-[(4-chlorophenyl)thio]-3-nitrophenyl]acrylic acid|3-{4-[(4-chlorophenyl)thio]-3-nitrophenyl}acrylic acid|3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]prop-2-enoic acid|3-(4-(4-Chlorophenylthio)-3-nitrophenyl)acrylic acid|2-Propenoic acid,3-[4-[(4-chlorophenyl)thio]-3-nitrophenyl]-|(E)-3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]prop-2-enoic acid|3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]prop-2-enoic Acid|3-{4-[(4-chlorophenyl)sulfanyl]-3-nitrophenyl}prop-2-enoic acid
| Molecular Formula | C15H10ClNO4S |
|---|---|
| Molecular Weight | 335.0019 g/mol |
| LogP | 4.4972 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.0019 |
| Monoisotopic Mass | 335.0019 |
| Heavy Atoms | 22 |
| Complexity | 743.7077 |
Chemical Identifiers
| CAS Number | 175278-52-1 |
|---|---|
| SMILES | C1=CC(=CC=C1SC2=C(C=C(C=C2)C=CC(=O)O)[N+](=O)[O-])Cl |
Product Overview
3-[4-[(4-Chlorophenyl)thio]-3-nitrophenyl]acrylic acid (CAS 175278-52-1), with molecular formula C15H10ClNO4S and molecular weight 335.0019 g/mol. IUPAC: 3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]prop-2-enoic acid.