Vitas-M small molecule compound

3,4'-dimethylbiphenyl-4-yl 2-nitrobenzenesulfonate

Catalog ID
STK388025
SMILES Cc1ccc(cc1)c1ccc(c(c1)C)OS(=O)(=O)c1ccccc1[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 C20H17NO5S MW 383.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S/c1-14-7-9-16(10-8-14)17-11-12-19(15(2)13-17)26-27(24,25)20-6-4-3-5-18(20)21(22)23/h3-13H,1-2H3
InChIKey
AYGYBDJWUCNSGG-UHFFFAOYSA-N
Synonyms
301658-05-9
(2METHYL4(4METHYLPHENYL)PHENYL)2NITROBENZENESULFONATE
2NITROBENZENESULFONICACID34DIMETHYLBIPHENYL4YLESTER
301658059
34DIMETHYLBIPHENYL4YL2NITROBENZENESULFONATE
CC1=CC=C(C=C1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O))C
Cc1ccc(cc1)c1ccc(c(c1)C)OS(=O)(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC20H17NO5Sc1147916(10814)17111219(15(2)1317)2627(2425)20643518(20)21(22)23h313H12H3
MFCD00360973
ZINC000001838538
ZINC01838538
ZINC1838538

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Available files

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