887580-89-4
1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLPROPYL)-AMINO]-AZETIDINE
Name1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLPROPYL)-AMINO]-AZETIDINE
1Identification
【Name】
1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLPROPYL)-AMINO]-AZETIDINE
【CAS】
【MDL】
MFCD07785950
【English Synonyms】
【Formula】
C16 H32 N4 O2
【MolWeight】
312.455
【Inchi】
InChI=1S/C16H32N4O2/c1-16(2,3)22-15(21)20-12-14(13-20)17-6-5-7-19-10-8-18(4)9-11-19/h14,17H,5-13H2,1-4H3
【InChIKey】
InChIKey=IJEBAQYWLMBEGQ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CC(C1)NCCCN2CCN(CC2)C
【MOL File】
1-BOC-3-[(4-METHYL-P….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLPROPYL)-AMINO]-AZETIDINE.cml