4-(Methylsulfonyl)-2-nitrobenzoic acid
CAS Registry Number®
110964-79-9
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CAS Name
4-(Methylsulfonyl)-2-nitrobenzoic acidMolecular Formula
C8H7NO6SMolecular Mass
245.21Cite this Page
4-(Methylsulfonyl)-2-nitrobenzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=110964-79-9 (retrieved ) (CAS RN: 110964-79-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
212-213 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)
InChIKey
InChIKey=QNOUABMNRMROSL-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=C(C(O)=O)C=CC(S(C)(=O)=O)=C1
Canonical SMILES
O=C(O)C1=CC=C(C=C1N(=O)=O)S(=O)(=O)C
Other Names for this Substance
- Benzoic acid, 4-(methylsulfonyl)-2-nitro-
- 4-(Methylsulfonyl)-2-nitrobenzoic acid
- 2-Nitro-4-(methylsulfonyl)benzoic acid
- 2-Nitro-p-methylsulfonyl benzoic acid
- 4-Mesyl-2-nitrobenzoic acid
