Vitas-M small molecule compound

4-(3-nitrophenyl)-4H-1,2,4-triazole

Catalog ID
STL139178
SMILES [O-][N+](=O)c1cccc(c1)n1cnnc1

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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 C8H6N4O2 MW 190.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N4O2/c13-12(14)8-3-1-2-7(4-8)11-5-9-10-6-11/h1-6H
InChIKey
MPPCZPMXXQYFAP-UHFFFAOYSA-N
Synonyms
36175-42-5
(O)(N+)(=O)c1cccc(c1)n1cnnc1
36175425
4(3nitrophenyl)124triazole
4(3nitrophenyl)4H124triazole
C1=CC(=CC(=C1)(N+)(=O)(O))N2C=NN=C2
InChI=1SC8H6N4O2c1312(14)83127(48)115910611h16H
MFCD18914815
ZINC000039331470
ZINC39331470

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Available files

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