175135-71-4
ETHYL 1-(2,4-DIFLUOROPHENYL)-5-METHYLPYRAZOLE-4-CARBOXYLATE
NameETHYL 1-(2,4-DIFLUOROPHENYL)-5-METHYLPYRAZOLE-4-CARBOXYLATE
pro_formulaC13 H12 F2 N2 O2
1Identification
【Name】
ETHYL 1-(2,4-DIFLUOROPHENYL)-5-METHYLPYRAZOLE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD00067830
【EnglishSynonyms】
【pro_formula】
C13 H12 F2 N2 O2
【pro_molWeight】
266.246
【Inchi】
InChI=1S/C13H12F2N2O2/c1-3-19-13(18)10-7-16-17(8(10)2)12-5-4-9(14)6-11(12)15/h4-7H,3H2,1-2H3
【InChIKey】
InChIKey=WVZDFYXWWMSKSH-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cnn(c1C)c2ccc(cc2F)F
【MOL File】
ETHYL 1-(2,4-DIFLUOR….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
ETHYL 1-(2,4-DIFLUOROPHENYL)-5-METHYLPYRAZOLE-4-CARBOXYLATE.cml