4-(Methylsulphonyl)-3-nitrobenzoic acid
4-methylsulfonyl-3-nitrobenzoic acid
Also Known As: 4-Methanesulfonyl-3-nitro-benzoic acid|4-methylsulfonyl-3-nitrobenzoic acid|4-(methylsulfonyl)-3-nitrobenzoic acid|4-methanesulfonyl-3-nitrobenzoic acid|4-methylsulfonyl-3-nitro-benzoic acid|Oprea1_254335|EINECS 279-676-6|4-(Methylsulphonyl)-3-nitrobenzoic acid|3-nitro-4-methylsulfonylbenzoic acid|4-Methanesulfonyl-3-nitro-benzoicacid|4-methylsulfonyl-3-nitro benzoic acid|4-(Methanesulfonyl)-3-nitrobenzoic acid|279-676-6
| Molecular Formula | C8H7NO6S |
|---|---|
| Molecular Weight | 244.9994 g/mol |
| LogP | 0.6965 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.9994 |
| Monoisotopic Mass | 244.9994 |
| Heavy Atoms | 16 |
| Complexity | 561.8913 |
Chemical Identifiers
| CAS Number | 81029-08-5 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-] |
Product Overview
4-(Methylsulphonyl)-3-nitrobenzoic acid (CAS 81029-08-5), with molecular formula C8H7NO6S and molecular weight 244.9994 g/mol. IUPAC: 4-methylsulfonyl-3-nitrobenzoic acid.
4-(Methylsulphonyl)-3-nitrobenzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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