5465-45-2
(4,5-DIMETHYLCYCLOHEX-4-ENE-1,2-DIYL)BIS[(4-CHLOROPHENYL)METHANONE]
Name(4,5-DIMETHYLCYCLOHEX-4-ENE-1,2-DIYL)BIS[(4-CHLOROPHENYL)METHANONE]
1Identification
【Name】
(4,5-DIMETHYLCYCLOHEX-4-ENE-1,2-DIYL)BIS[(4-CHLOROPHENYL)METHANONE]
【CAS】
【MDL】
MFCD19705357
【English Synonyms】
【Formula】
C22 H20 Cl2 O2
【MolWeight】
387.304
【Inchi】
InChI=1S/C22H20Cl2O2/c1-13-11-19(21(25)15-3-7-17(23)8-4-15)20(12-14(13)2)22(26)16-5-9-18(24)10-6-16/h3-10,19-20H,11-12H2,1-2H3
【InChIKey】
InChIKey=JFFNOWDOXGQGEO-UHFFFAOYSA-N
【SMILES】
CC1=C(CC(C(C1)C(=O)c2ccc(cc2)Cl)C(=O)c3ccc(cc3)Cl)C
【MOL File】
(4,5-DIMETHYLCYCLOHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(4,5-DIMETHYLCYCLOHEX-4-ENE-1,2-DIYL)BIS[(4-CHLOROPHENYL)METHANONE].cml