591778-76-6
1-[1-(TERT-BUTOXYCARBONYL)AZETIDIN-3-YL]PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
Name1-[1-(TERT-BUTOXYCARBONYL)AZETIDIN-3-YL]PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
1-[1-(TERT-BUTOXYCARBONYL)AZETIDIN-3-YL]PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD13190570
【English Synonyms】
【Formula】
C16 H28 N2 O4
【MolWeight】
312.407
【Inchi】
InChI=1S/C16H28N2O4/c1-5-21-14(19)12-7-6-8-17(9-12)13-10-18(11-13)15(20)22-16(2,3)4/h12-13H,5-11H2,1-4H3
【InChIKey】
InChIKey=IGDPWQOIWCKINL-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1CCCN(C1)C2CN(C2)C(=O)OC(C)(C)C
【MOL File】
1-[1-(TERT-BUTOXYCAR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-[1-(TERT-BUTOXYCARBONYL)AZETIDIN-3-YL]PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER.cml