4-((2,5-Dichlorophenyl)thio)-3-nitrobenzoic acid
4-(2,5-dichlorophenyl)sulfanyl-3-nitrobenzoic acid
Also Known As: 4-[(2,5-dichlorophenyl)thio]-3-nitrobenzoic acid|4-((2,5-Dichlorophenyl)thio)-3-nitrobenzoic acid|4-(2,5-dichlorophenyl)sulfanyl-3-nitrobenzoic acid|4-(2,5-dichlorophenyl)sulfanyl-3-nitro-benzoic Acid|4-[(2,5-Dichlorophenyl)sulfanyl]-3-nitrobenzoic acid
CAS: 652967-65-2
| Molecular Formula | C13H7Cl2NO4S |
|---|---|
| Molecular Weight | 342.9473 g/mol |
| LogP | 4.751 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.9473 |
| Monoisotopic Mass | 342.9473 |
| Heavy Atoms | 21 |
| Complexity | 736.1064 |
Chemical Identifiers
| CAS Number | 652967-65-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])SC2=C(C=CC(=C2)Cl)Cl |
Product Overview
4-((2,5-Dichlorophenyl)thio)-3-nitrobenzoic acid (CAS 652967-65-2), with molecular formula C13H7Cl2NO4S and molecular weight 342.9473 g/mol. IUPAC: 4-(2,5-dichlorophenyl)sulfanyl-3-nitrobenzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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