Vitas-M small molecule compound

1-nitro-3-(prop-2-en-1-ylsulfonyl)benzene

Catalog ID
STK177369
SMILES C=CCS(=O)(=O)c1cccc(c1)[N+](=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 C9H9NO4S MW 227.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO4S/c1-2-6-15(13,14)9-5-3-4-8(7-9)10(11)12/h2-5,7H,1,6H2
InChIKey
DFHPXMHXPTWWHK-UHFFFAOYSA-N
Synonyms
3729-41-7
1NITRO3(PROP2EN1YLSULFONYL)BENZENE
1NITRO3PROP2ENYLSULFONYLBENZENE
3729417
3NITROPHENYLALLYLSULFONE
BENZENE1NITRO3(2PROPENYLSULFONYL)
C=CCS(=O)(=O)C1=CC=CC(=C1)(N+)(=O)(O)
C=CCS(=O)(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC9H9NO4Sc12615(1314)95348(79)10(11)12h257H16H2
MFCD01218634
ZINC000000315713
ZINC00315713
ZINC315713

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Available files

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