Vitas-M small molecule compound

1-methyl-7-nitro-1H-benzotriazole

Catalog ID
STK370132
SMILES [O-][N+](=O)c1cccc2c1n(C)nn2

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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 C7H6N4O2 MW 178.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H6N4O2/c1-10-7-5(8-9-10)3-2-4-6(7)11(12)13/h2-4H,1H3
InChIKey
XCAKJJBLSHSJNZ-UHFFFAOYSA-N
Synonyms
14209-07-5
(O)(N+)(=O)c1cccc2c1n(C)nn2
14209075
1HBENZOTRIAZOLE1METHYL7NITRO
1METHYL7NITRO1H123BENZOTRIAZOLE
1methyl7nitro1Hbenzotriazole
1METHYL7NITROBENZOTRIAZOLE
7NITRO1METHYLBENZOTRIAZOLE
CN1C2=C(C=CC=C2(N+)(=O)(O))N=N1
InChI=1SC7H6N4O2c11075(8910)3246(7)11(12)13h24H1H3
MFCD00456077
ZINC000003163041
ZINC03163041
ZINC3163041

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Available files

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