898781-29-8
ETHYL 6-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-6-OXOHEXANOATE
NameETHYL 6-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-6-OXOHEXANOATE
1Identification
【Name】
ETHYL 6-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-6-OXOHEXANOATE
【CAS】
【MDL】
MFCD03842740
【English Synonyms】
【Formula】
C22 H31 N O5
【MolWeight】
389.489
【Inchi】
InChI=1S/C22H31NO5/c1-2-26-21(25)10-6-5-9-20(24)19-8-4-3-7-18(19)17-23-13-11-22(12-14-23)27-15-16-28-22/h3-4,7-8H,2,5-6,9-17H2,1H3
【InChIKey】
InChIKey=SCXOYUXRBUANAC-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCCCC(=O)c1ccccc1CN2CCC3(CC2)OCCO3
【MOL File】
ETHYL 6-[2-[8-(1,4-D….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 6-[2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-6-OXOHEXANOATE.cml