Vitas-M small molecule compound
1-[2-nitro-4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole
Catalog ID
STK351156
SMILES [O-][N+](=O)c1cc(ccc1n1cncn1)C(F)(F)F
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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 C9H5F3N4O2 MW 258.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H5F3N4O2/c10-9(11,12)6-1-2-7(8(3-6)16(17)18)15-5-13-4-14-15/h1-5HInChIKey
KZMGWGNOCPTZDA-UHFFFAOYSA-NSynonyms
314250-25-4(O)(N+)(=O)c1cc(ccc1n1cncn1)C(F)(F)F
1(2NITRO4(TRIFLUOROMETHYL)PHENYL)124TRIAZOLE
1(2nitro4(trifluoromethyl)phenyl)1H124triazole
314250254
C1=CC(=C(C=C1C(F)(F)F)(N+)(=O)(O))N2C=NC=N2
InChI=1SC9H5F3N4O2c109(1112)6127(8(36)16(17)18)1551341415h15H
MFCD00585456
ZINC000000202135
ZINC00202135
ZINC202135
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