Vitas-M small molecule compound

4-methyl-2-nitrophenyl thiocyanate

Catalog ID
STK369155
SMILES N#CSc1ccc(cc1[N+](=O)[O-])C

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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 C8H6N2O2S MW 194.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N2O2S/c1-6-2-3-8(13-5-9)7(4-6)10(11)12/h2-4H,1H3
InChIKey
FOUCYKKDWSELGL-UHFFFAOYSA-N
Synonyms
71215-88-8
(4METHYL2NITROPHENYL)THIOCARBONITRILE
(4METHYL2NITROPHENYL)THIOCYANATE
4methyl2nitrophenylthiocyanate
71215888
CC1=CC(=C(C=C1)SC#N)(N+)(=O)(O)
InChI=1SC8H6N2O2Sc16238(1359)7(46)10(11)12h24H1H3
MFCD00462395
N#CSc1ccc(cc1(N+)(=O)(O))C
THIOCYANICACID4METHYL2NITROPHENYLESTER
ZINC000003164730
ZINC03164730
ZINC3164730

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Available files

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