917388-62-6
ETHYL 3-(3-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CARBOXYLATE
NameETHYL 3-(3-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CARBOXYLATE
pro_formulaC13 H12 F N O3
1Identification
【Name】
ETHYL 3-(3-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD09756446
【EnglishSynonyms】
【pro_formula】
C13 H12 F N O3
【pro_molWeight】
249.24
【Inchi】
InChI=1S/C13H12FNO3/c1-3-17-13(16)11-8(2)18-15-12(11)9-5-4-6-10(14)7-9/h4-7H,3H2,1-2H3
【InChIKey】
InChIKey=MUOSZNUSOIVVIR-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(onc1c2cccc(c2)F)C
【MOL File】
ETHYL 3-(3-FLUOROPHE….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
ETHYL 3-(3-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CARBOXYLATE.cml