4-[(4-Methylphenyl)sulfonyl]-3-nitrobenzoic acid
4-(4-methylphenyl)sulfonyl-3-nitrobenzoic acid
Also Known As: Maybridge1_001578|4-[(4-methylphenyl)sulfonyl]-3-nitrobenzoic acid|Oprea1_647350|HMS545P16|Phenol,4-[(hydroxymethoxy)methyl]|4-(4-methylphenyl)sulfonyl-3-nitrobenzoic acid|4-(4-Methylbenzene-1-sulfonyl)-3-nitrobenzoic acid
CAS: 90352-45-7
| Molecular Formula | C14H11NO6S |
|---|---|
| Molecular Weight | 321.0307 g/mol |
| LogP | 2.43422 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.0307 |
| Monoisotopic Mass | 321.0307 |
| Heavy Atoms | 22 |
| Complexity | 855.40186 |
Chemical Identifiers
| CAS Number | 90352-45-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-] |
Product Overview
4-[(4-Methylphenyl)sulfonyl]-3-nitrobenzoic acid (CAS 90352-45-7), with molecular formula C14H11NO6S and molecular weight 321.0307 g/mol. IUPAC: 4-(4-methylphenyl)sulfonyl-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 →
4-[(4-Methylphenyl)sulfonyl]-3-nitrobenzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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