Vitas-M small molecule compound

1-(2-methylbenzyl)-3-nitro-1H-1,2,4-triazole

Catalog ID
STL176626
SMILES Cc1ccccc1Cn1cnc(n1)[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 C10H10N4O2 MW 218.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N4O2/c1-8-4-2-3-5-9(8)6-13-7-11-10(12-13)14(15)16/h2-5,7H,6H2,1H3
InChIKey
KCXQFPHFIWQJMQ-UHFFFAOYSA-N
Synonyms
677730-24-4
1((2METHYLPHENYL)METHYL)3NITRO124TRIAZOLE
1(2methylbenzyl)3nitro1H124triazole
677730244
CC1=CC=CC=C1CN2C=NC(=N2)(N+)(=O)(O)
Cc1ccccc1Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC10H10N4O2c1842359(8)61371110(1213)14(15)16h257H6H21H3
MFCD04049987
ZINC000004821204
ZINC04821204
ZINC4821204

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Available files

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