727696-15-3
2-CHLORO-1-(1-[4-(DIFLUOROMETHOXY)PHENYL]-2,5-DIMETHYL-1H-PYRROL-3-YL)PROPAN-1-ONE
Name2-CHLORO-1-(1-[4-(DIFLUOROMETHOXY)PHENYL]-2,5-DIMETHYL-1H-PYRROL-3-YL)PROPAN-1-ONE
FormulaC16 H16 Cl F2 N O2
1Identification
【Name】
2-CHLORO-1-(1-[4-(DIFLUOROMETHOXY)PHENYL]-2,5-DIMETHYL-1H-PYRROL-3-YL)PROPAN-1-ONE
【CAS】
【MDL】
MFCD04617321
【English Synonyms】
【Formula】
C16 H16 Cl F2 N O2
【MolWeight】
327.756
【Inchi】
InChI=1S/C16H16ClF2NO2/c1-9-8-14(15(21)10(2)17)11(3)20(9)12-4-6-13(7-5-12)22-16(18)19/h4-8,10,16H,1-3H3
【InChIKey】
InChIKey=DJCARZPPCAKQEL-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(n1c2ccc(cc2)OC(F)F)C)C(=O)C(C)Cl
【MOL File】
2-CHLORO-1-(1-[4-(DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-1-(1-[4-(DIFLUOROMETHOXY)PHENYL]-2,5-DIMETHYL-1H-PYRROL-3-YL)PROPAN-1-ONE.cml