7472-83-5
2-(3-OXO-1,3-DIPHENYL-PROPYL)-MALONIC ACID DIETHYL ESTER
Name2-(3-OXO-1,3-DIPHENYL-PROPYL)-MALONIC ACID DIETHYL ESTER
1Identification
【Name】
2-(3-OXO-1,3-DIPHENYL-PROPYL)-MALONIC ACID DIETHYL ESTER
【CAS】
【MDL】
MFCD00221926
【English Synonyms】
【Formula】
C22 H24 O5
【MolWeight】
368.427
【Inchi】
InChI=1S/C22H24O5/c1-3-26-21(24)20(22(25)27-4-2)18(16-11-7-5-8-12-16)15-19(23)17-13-9-6-10-14-17/h5-14,18,20H,3-4,15H2,1-2H3
【InChIKey】
InChIKey=GUJPBXVQEMZFLL-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C(CC(=O)c1ccccc1)c2ccccc2)C(=O)OCC
【MOL File】
2-(3-OXO-1,3-DIPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(3-OXO-1,3-DIPHENYL-PROPYL)-MALONIC ACID DIETHYL ESTER.cml