Vitas-M small molecule compound

3,3-dimethyl-1-(naphthalen-2-ylsulfonyl)butan-2-one

Catalog ID
STK205577
SMILES O=C(C(C)(C)C)CS(=O)(=O)c1ccc2c(c1)cccc2

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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 C16H18O3S MW 290.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18O3S/c1-16(2,3)15(17)11-20(18,19)14-9-8-12-6-4-5-7-13(12)10-14/h4-10H,11H2,1-3H3
InChIKey
STFORMZKLOEQDS-UHFFFAOYSA-N
Synonyms

33DIMETHYL1(2NAPHTHYLSULFONYL)2BUTANONE
33DIMETHYL1(NAPHTHALEN2YLSULFONYL)BUTAN2ONE
33DIMETHYL1NAPHTHALEN2YLSULFONYLBUTAN2ONE
CC(C)(C)C(=O)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1
InChI=1SC16H18O3Sc116(23)15(17)1120(1819)149812645713(12)1014h410H11H213H3
MFCD04092194
ZINC000000386128
ZINC00386128
ZINC386128

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Available files

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