Vitas-M small molecule compound
methyl 3,5-dinitro-4-(4H-1,2,4-triazol-4-yl)benzoate
Catalog ID
STK726712
SMILES COC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])n1cnnc1
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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 C10H7N5O6 MW 293.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H7N5O6/c1-21-10(16)6-2-7(14(17)18)9(8(3-6)15(19)20)13-4-11-12-5-13/h2-5H,1H3InChIKey
KCNFHCTUGCBALN-UHFFFAOYSA-NSynonyms
111622-68-5111622685
35DINITRO4(124)TRIAZOL4YLBENZOICACIDMETHYLESTER
COC(=O)C1=CC(=C(C(=C1)(N+)(=O)(O))N2C=NN=C2)(N+)(=O)(O)
COC(=O)c1cc((N+)(=O)(O))c(c(c1)(N+)(=O)(O))n1cnnc1
InChI=1SC10H7N5O6c12110(16)627(14(17)18)9(8(36)15(19)20)1341112513h25H1H3
METHYL35DINITRO4(124TRIAZOL4YL)BENZOATE
methyl35dinitro4(4H124triazol4yl)benzoate
MFCD01208166
ZINC000008818258
ZINC08818258
ZINC8818258
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