Vitas-M small molecule compound
sodium (2E)-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1,1-difluoro-4-oxobut-2-en-2-olate
Catalog ID
STK349610
SMILES CCn1ncc(c1C)C(=O)/C=C(\C(F)F)/O[Na]
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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 C10H11F2N2NaO2 MW 252.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12F2N2O2.Na/c1-3-14-6(2)7(5-13-14)8(15)4-9(16)10(11)12;/h4-5,10,16H,3H2,1-2H3;/q;+1/p-1/b9-4+;InChIKey
DQLSKISQOFQTFW-JOKMOOFLSA-MSynonyms
CCN1C(=C(C=N1)C(=O)C=C(C(F)F)(O))C(Na+)
CCn1ncc(c1C)C(=O)C=C(C(F)F)O(Na)
InChI=1SC10H12F2N2O2Nac13146(2)7(51314)8(15)49(16)10(11)12h451016H3H212H3q+1p1b94+
MFCD04969790
sodium(2E)4(1ethyl5methyl1Hpyrazol4yl)11difluoro4oxobut2en2olate
sodium(E)4(1ethyl5methylpyrazol4yl)11difluoro4oxobut2en2olate
SODIUM4(1ETHYL5METHYL1HPYRAZOL4YL)11DIFLUORO4OXOBUT2EN2OLATE
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