Vitas-M small molecule compound
1-(2,4-dimethylbenzyl)-3-nitro-1H-1,2,4-triazole
Catalog ID
STL057760
SMILES Cc1ccc(c(c1)C)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 C11H12N4O2 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O2/c1-8-3-4-10(9(2)5-8)6-14-7-12-11(13-14)15(16)17/h3-5,7H,6H2,1-2H3InChIKey
LSODQPLWVNWNAA-UHFFFAOYSA-NSynonyms
714284-88-51((24DIMETHYLPHENYL)METHYL)3NITRO124TRIAZOLE
1(24dimethylbenzyl)3nitro1H124triazole
714284885
CC1=CC(=C(C=C1)CN2C=NC(=N2)(N+)(=O)(O))C
Cc1ccc(c(c1)C)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC11H12N4O2c183410(9(2)58)61471211(1314)15(16)17h357H6H212H3
MFCD05679424
ZINC000005296876
ZINC05296876
ZINC5296876
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