Vitas-M small molecule compound
methyl 5-(methoxymethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK767214
SMILES COCc1c(nnn1c1ccc(cc1[N+](=O)[O-])C(F)(F)F)C(=O)OC
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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 C13H11F3N4O5 MW 360.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11F3N4O5/c1-24-6-10-11(12(21)25-2)17-18-19(10)8-4-3-7(13(14,15)16)5-9(8)20(22)23/h3-5H,6H2,1-2H3InChIKey
VTOIAHFMPUTWPD-UHFFFAOYSA-NSynonyms
5METHOXYMETHYL1(2NITRO4TRIFLUOROMETHYLPHENYL)1H(123)TRIAZOLE4CARBOXYLICACIDMETHYLESTER
COCC1=C(N=NN1C2=C(C=C(C=C2)C(F)(F)F)(N+)(=O)(O))C(=O)OC
COCc1c(nnn1c1ccc(cc1(N+)(=O)(O))C(F)(F)F)C(=O)OC
InChI=1SC13H11F3N4O5c12461011(12(21)252)171819(10)8437(13(1415)16)59(8)20(22)23h35H6H212H3
METHYL5(METHOXYMETHYL)1(2NITRO4(TRIFLUOROMETHYL)PHENYL)123TRIAZOLE4CARBOXYLATE
methyl5(methoxymethyl)1(2nitro4(trifluoromethyl)phenyl)1H123triazole4carboxylate
METHYL5(METHOXYMETHYL)1(2NITRO4(TRIFLUOROMETHYL)PHENYL)TRIAZOLE4CARBOXYLATE
MFCD03034274
ZINC000001085877
ZINC01085877
ZINC1085877
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