Vitas-M small molecule compound

2-(butylsulfonyl)benzoic acid

Catalog ID
STK505880
SMILES CCCCS(=O)(=O)c1ccccc1C(=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 C11H14O4S MW 242.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14O4S/c1-2-3-8-16(14,15)10-7-5-4-6-9(10)11(12)13/h4-7H,2-3,8H2,1H3,(H,12,13)
InChIKey
RHHIBSFKGKUZBX-UHFFFAOYSA-N
Synonyms
57076-15-0
2(BUTANE1SULFONYL)BENZOICACID
2(butylsulfonyl)benzoicacid
2butylsulfonylbenzoicacid
57076150
CCCCS(=O)(=O)C1=CC=CC=C1C(=O)O
InChI=1SC11H14O4Sc123816(1415)1075469(10)11(12)13h47H238H21H3(H1213)
MFCD09947080
ZINC000019510734
ZINC19510734

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.