Vitas-M small molecule compound
methyl 1-[2-nitro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylate
Catalog ID
STK351718
SMILES COC(=O)c1ccn(n1)c1ccc(cc1[N+](=O)[O-])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 C12H8F3N3O4 MW 315.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8F3N3O4/c1-22-11(19)8-4-5-17(16-8)9-3-2-7(12(13,14)15)6-10(9)18(20)21/h2-6H,1H3InChIKey
YDRMVEHNRMDTDT-UHFFFAOYSA-NSynonyms
1171236-26-21171236262
COC(=O)C1=NN(C=C1)C2=C(C=C(C=C2)C(F)(F)F)(N+)(=O)(O)
COC(=O)c1ccn(n1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC12H8F3N3O4c12211(19)84517(168)9327(12(1314)15)610(9)18(20)21h26H1H3
methyl1(2nitro4(trifluoromethyl)phenyl)1Hpyrazole3carboxylate
METHYL1(2NITRO4(TRIFLUOROMETHYL)PHENYL)PYRAZOLE3CARBOXYLATE
MFCD09473481
ZINC000012395992
ZINC12395992
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