Vitas-M small molecule compound
4-methyl-3-nitrobenzenesulfonic acid
Catalog ID
STK372681
SMILES [O-][N+](=O)c1cc(ccc1C)S(=O)(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C7H7NO5S MW 217.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H7NO5S/c1-5-2-3-6(14(11,12)13)4-7(5)8(9)10/h2-4H,1H3,(H,11,12,13)InChIKey
GJYYWZTYFNSZRP-UHFFFAOYSA-NSynonyms
97-06-3(O)(N+)(=O)c1cc(ccc1C)S(=O)(=O)O
1METHYL2NITROBENZENE4SULFONICACID
2NITROPTOLUENESULPHONICACID
2NITROTOLUENE4SULFONICACID
3NITRO4METHYLBENZENESULFONICACID
4METHYL3NITROBENZENE1SULFONICACID
4methyl3nitrobenzenesulfonicacid
4METHYL3NITROBENZENSULFONICACID
97063
BENZENESULFONICACID4METHYL3NITRO
CC1=C(C=C(C=C1)S(=O)(=O)O)(N+)(=O)(O)
InChI=1SC7H7NO5Sc15236(14(1112)13)47(5)8(9)10h24H1H3(H111213)
MFCD00035917
ZINC000001848457
ZINC1848457
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