Vitas-M small molecule compound
1-(3-chlorobenzyl)-3-nitro-1H-1,2,4-triazole
Catalog ID
STL176692
SMILES Clc1cccc(c1)Cn1cnc(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 C9H7ClN4O2 MW 238.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7ClN4O2/c10-8-3-1-2-7(4-8)5-13-6-11-9(12-13)14(15)16/h1-4,6H,5H2InChIKey
CHWBRWAYQFXOQT-UHFFFAOYSA-NSynonyms
677015-80-41((3CHLOROPHENYL)METHYL)3NITRO124TRIAZOLE
1(3chlorobenzyl)3nitro1H124triazole
677015804
C1=CC(=CC(=C1)Cl)CN2C=NC(=N2)(N+)(=O)(O)
Clc1cccc(c1)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC9H7ClN4O2c1083127(48)5136119(1213)14(15)16h146H5H2
MFCD02029287
ZINC000002785617
ZINC02785617
ZINC2785617
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