4-(2-Carboxy-phenylsulfanyl)-3-nitro-benzoic acid
4-(2-carboxyphenyl)sulfanyl-3-nitrobenzoic acid
Also Known As: Oprea1_242001|NCGC00320125-01|2-(4-carboxy-2-nitrophenylthio)benzoic acid|4-(2-Carboxyphenylthio)-3-nitrobenzoic acid|4-(2-carboxy-phenylsulfanyl)-3-nitro-benzoic acid|4-[(2-carboxyphenyl)sulfanyl]-3-nitrobenzoic acid|4-(2-carboxyphenyl)sulfanyl-3-nitrobenzoic acid|AB01316921-02|4-(2-carboxyphenyl)sulfanyl-3-nitro-benzoic Acid|SR-01000102804-1
| Molecular Formula | C14H9NO6S |
|---|---|
| Molecular Weight | 319.01505 g/mol |
| LogP | 3.1424 |
| Topological Polar Surface Area | 117.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.01505 |
| Monoisotopic Mass | 319.01505 |
| Heavy Atoms | 22 |
| Complexity | 773.6784 |
Chemical Identifiers
| CAS Number | 6525-41-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)SC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-] |
Product Overview
4-(2-Carboxy-phenylsulfanyl)-3-nitro-benzoic acid (CAS 6525-41-3), with molecular formula C14H9NO6S and molecular weight 319.01505 g/mol. IUPAC: 4-(2-carboxyphenyl)sulfanyl-3-nitrobenzoic acid.
4-(2-Carboxy-phenylsulfanyl)-3-nitro-benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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