852399-92-9
5-(CHLOROMETHYL)-3-[4-(DIFLUOROMETHOXY)-3-METHOXYPHENYL]-1,2,4-OXADIAZOLE
Name5-(CHLOROMETHYL)-3-[4-(DIFLUOROMETHOXY)-3-METHOXYPHENYL]-1,2,4-OXADIAZOLE
FormulaC11 H9 Cl F2 N2 O3
1Identification
【Name】
5-(CHLOROMETHYL)-3-[4-(DIFLUOROMETHOXY)-3-METHOXYPHENYL]-1,2,4-OXADIAZOLE
【CAS】
【MDL】
MFCD06655336
【English Synonyms】
【Formula】
C11 H9 Cl F2 N2 O3
【MolWeight】
290.652
【Inchi】
InChI=1S/C11H9ClF2N2O3/c1-17-8-4-6(2-3-7(8)18-11(13)14)10-15-9(5-12)19-16-10/h2-4,11H,5H2,1H3
【InChIKey】
InChIKey=ZKOVEAHABYHMSB-UHFFFAOYSA-N
【SMILES】
COc1cc(ccc1OC(F)F)c2nc(on2)CCl
【MOL File】
5-(CHLOROMETHYL)-3-[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(CHLOROMETHYL)-3-[4-(DIFLUOROMETHOXY)-3-METHOXYPHENYL]-1,2,4-OXADIAZOLE.cml