512177-31-0
2H-PYRROL-2-ONE, 4-ACETYL-1-(4-CHLORO-2-FLUOROPHENYL)-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-
Name2H-PYRROL-2-ONE, 4-ACETYL-1-(4-CHLORO-2-FLUOROPHENYL)-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-
1Identification
【Name】
2H-PYRROL-2-ONE, 4-ACETYL-1-(4-CHLORO-2-FLUOROPHENYL)-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-
【CAS】
【MDL】
MFCD11616186
【English Synonyms】
【Formula】
C18 H19 Cl F N O3
【MolWeight】
351.803
【Inchi】
InChI=1S/C18H19ClFNO3/c1-10(22)15-16(11-5-3-2-4-6-11)21(18(24)17(15)23)14-8-7-12(19)9-13(14)20/h7-9,11,16,23H,2-6H2,1H3
【InChIKey】
InChIKey=VQNLJXWZGVRLBA-UHFFFAOYSA-N
【SMILES】
CC(=O)C1=C(C(=O)N(C1C2CCCCC2)c3ccc(cc3F)Cl)O
【MOL File】
2H-PYRROL-2-ONE, 4-A….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2H-PYRROL-2-ONE, 4-ACETYL-1-(4-CHLORO-2-FLUOROPHENYL)-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-.cml