1095208-36-8
2'-4'-DIFLUORO-3-(PROPYLCARBAMOYL)BIPHENYL-4-YL BENZOATE
Name2'-4'-DIFLUORO-3-(PROPYLCARBAMOYL)BIPHENYL-4-YL BENZOATE
1Identification
【Name】
2'-4'-DIFLUORO-3-(PROPYLCARBAMOYL)BIPHENYL-4-YL BENZOATE
【CAS】
【MDL】
MFCD16877257
【English Synonyms】
【Formula】
C23 H19 F2 N O3
【MolWeight】
395.403
【Inchi】
InChI=1S/C23H19F2NO3/c1-2-12-26-22(27)19-13-16(18-10-9-17(24)14-20(18)25)8-11-21(19)29-23(28)15-6-4-3-5-7-15/h3-11,13-14H,2,12H2,1H3,(H,26,27)
【InChIKey】
InChIKey=XQDBVIQJWNZKMO-UHFFFAOYSA-N
【SMILES】
CCCNC(=O)c1cc(ccc1OC(=O)c2ccccc2)c3ccc(cc3F)F
【MOL File】
2'-4'-DIFLUORO-3-(PR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2'-4'-DIFLUORO-3-(PROPYLCARBAMOYL)BIPHENYL-4-YL BENZOATE.cml