646989-58-4
5-(CHLOROMETHYL)-3-[3,5-DI(TRIFLUOROMETHYL)STYRYL]-1,2,4-OXADIAZOLE
Name5-(CHLOROMETHYL)-3-[3,5-DI(TRIFLUOROMETHYL)STYRYL]-1,2,4-OXADIAZOLE
pro_formulaC13 H7 Cl F6 N2 O
1Identification
【Name】
5-(CHLOROMETHYL)-3-[3,5-DI(TRIFLUOROMETHYL)STYRYL]-1,2,4-OXADIAZOLE
【CAS】
【MDL】
MFCD00113523
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H7 Cl F6 N2 O
【pro_molWeight】
356.652
【Inchi】
InChI=1S/C13H7ClF6N2O/c14-6-11-21-10(22-23-11)2-1-7-3-8(12(15,16)17)5-9(4-7)13(18,19)20/h1-5H,6H2/b2-1+
【InChIKey】
InChIKey=ZELCQHTUHQJRCV-OWOJBTEDSA-N
【SMILES】
c1c(cc(cc1C(F)(F)F)C(F)(F)F)/C=C/c2nc(on2)CCl
【MOL File】
5-(CHLOROMETHYL)-3-[….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-(CHLOROMETHYL)-3-[3,5-DI(TRIFLUOROMETHYL)STYRYL]-1,2,4-OXADIAZOLE.cml