Vitas-M small molecule compound
1-(3,5-dinitro-1H-1,2,4-triazol-1-yl)propan-2-one
Catalog ID
STK675863
SMILES CC(=O)Cn1nc(nc1[N+](=O)[O-])[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 C5H5N5O5 MW 215.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H5N5O5/c1-3(11)2-8-5(10(14)15)6-4(7-8)9(12)13/h2H2,1H3InChIKey
GIXLKJRGNJIETC-UHFFFAOYSA-NSynonyms
1(35DINITRO124TRIAZOL1YL)PROPAN2ONE
1(35DINITRO124TRIAZOLYL)2PROPANONE
1(35DINITRO124TRIAZOLYL)ACETONE
1(35dinitro1H124triazol1yl)propan2one
CC(=O)CN1C(=NC(=N1)(N+)(=O)(O))(N+)(=O)(O)
CC(=O)Cn1nc(nc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC5H5N5O5c13(11)285(10(14)15)64(78)9(12)13h2H21H3
MFCD01820803
ZINC000004342436
ZINC04342436
ZINC4342436
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