Vitas-M small molecule compound
2-(tert-butylsulfonyl)benzene-1,3-dicarboxylic acid
Catalog ID
STK525762
SMILES OC(=O)c1cccc(c1S(=O)(=O)C(C)(C)C)C(=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 C12H14O6S MW 286.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14O6S/c1-12(2,3)19(17,18)9-7(10(13)14)5-4-6-8(9)11(15)16/h4-6H,1-3H3,(H,13,14)(H,15,16)InChIKey
PMZOXOVSADJDMD-UHFFFAOYSA-NSynonyms
62261-24-913BENZENEDICARBOXYLICACID2((11DIMETHYLETHYL)SULFONYL)
2(tertbutylsulfonyl)benzene13dicarboxylicacid
2(tertbutylsulfonyl)isophthalicacid
2TERTBUTYLSULFONYLBENZENE13DICARBOXYLICACID
62261249
CC(C)(C)S(=O)(=O)C1=C(C=CC=C1C(=O)O)C(=O)O
InChI=1SC12H14O6Sc112(23)19(1718)97(10(13)14)5468(9)11(15)16h46H13H3(H1314)(H1516)
MFCD00473824
ZINC000004337856
ZINC4337856
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