Vitas-M small molecule compound
1-benzyl-3-nitro-1H-1,2,4-triazole
Catalog ID
STL405585
SMILES [O-][N+](=O)c1ncn(n1)Cc1ccccc1
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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 C9H8N4O2 MW 204.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N4O2/c14-13(15)9-10-7-12(11-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2InChIKey
UKKSDGCKRNHUHY-UHFFFAOYSA-NSynonyms
136118-54-2(O)(N+)(=O)c1ncn(n1)Cc1ccccc1
136118542
1BENZYL3NITRO124TRIAZOLE
1benzyl3nitro1H124triazole
3NITRO1BENZYL124TRIAZOLE
C1=CC=C(C=C1)CN2C=NC(=N2)(N+)(=O)(O)
InChI=1SC9H8N4O2c1413(15)910712(119)68421358h157H6H2
MFCD01421956
ZINC000000484238
ZINC00484238
ZINC484238
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