898763-96-7
ETHYL 4-OXO-4-[2-(3-PYRROLINOMETHYL)PHENYL]BUTYRATE
NameETHYL 4-OXO-4-[2-(3-PYRROLINOMETHYL)PHENYL]BUTYRATE
1Identification
【Name】
ETHYL 4-OXO-4-[2-(3-PYRROLINOMETHYL)PHENYL]BUTYRATE
【CAS】
【MDL】
MFCD03842909
【English Synonyms】
【Formula】
C17 H21 N O3
【MolWeight】
287.357
【Inchi】
InChI=1S/C17H21NO3/c1-2-21-17(20)10-9-16(19)15-8-4-3-7-14(15)13-18-11-5-6-12-18/h3-8H,2,9-13H2,1H3
【InChIKey】
InChIKey=KJMOZDPCFAAFPX-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCC(=O)c1ccccc1CN2CC=CC2
【MOL File】
ETHYL 4-OXO-4-[2-(3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-OXO-4-[2-(3-PYRROLINOMETHYL)PHENYL]BUTYRATE.cml