1188208-67-4
3-(3,4-DICHLOROPHENYL)-5-(3,5-DIMETHYLPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
Name3-(3,4-DICHLOROPHENYL)-5-(3,5-DIMETHYLPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
pro_formulaC20 H17 Cl2 N O3
1Identification
【Name】
3-(3,4-DICHLOROPHENYL)-5-(3,5-DIMETHYLPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD17184851
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C20 H17 Cl2 N O3
【pro_molWeight】
390.264
【Inchi】
InChI=1S/C20H17Cl2NO3/c1-4-25-20(24)17-18(13-5-6-15(21)16(22)10-13)23-26-19(17)14-8-11(2)7-12(3)9-14/h5-10H,4H2,1-3H3
【InChIKey】
InChIKey=SVZSWCSDQFQOQK-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(noc1c2cc(cc(c2)C)C)c3ccc(c(c3)Cl)Cl
【MOL File】
3-(3,4-DICHLOROPHENY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:6.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-(3,4-DICHLOROPHENYL)-5-(3,5-DIMETHYLPHENYL)-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER.cml