Vitas-M small molecule compound

5-bromo-1-(diphenylmethyl)-3-nitro-1H-1,2,4-triazole

Catalog ID
STK556105
SMILES [O-][N+](=O)c1nn(c(n1)Br)C(c1ccccc1)c1ccccc1

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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 C15H11BrN4O2 MW 359.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN4O2/c16-14-17-15(20(21)22)18-19(14)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChIKey
KIHCVCUIZGRMPW-UHFFFAOYSA-N
Synonyms
674353-46-9
(O)(N+)(=O)c1nn(c(n1)Br)C(c1ccccc1)c1ccccc1
1BENZHYDRYL5BROMO3NITRO124TRIAZOLE
1benzhydryl5bromo3nitro1H124triazole
5bromo1(diphenylmethyl)3nitro1H124triazole
674353469
C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C(=NC(=N3)(N+)(=O)(O))Br
InChI=1SC15H11BrN4O2c16141715(20(21)22)1819(14)13(117314811)1295261012h11013H
MFCD03196575
ZINC000005046836
ZINC05046836
ZINC5046836

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Available files

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