548461-30-9
(3AR,9AS)-REL-2,3,3A,4,9,9A-HEXAHYDRO-1H-CYCLOPENTA[B]QUINOLINE
Name(3AR,9AS)-REL-2,3,3A,4,9,9A-HEXAHYDRO-1H-CYCLOPENTA[B]QUINOLINE
1Identification
【Name】
(3AR,9AS)-REL-2,3,3A,4,9,9A-HEXAHYDRO-1H-CYCLOPENTA[B]QUINOLINE
【CAS】
【MDL】
MFCD13184105
【English Synonyms】
【Formula】
C12 H15 N
【MolWeight】
173.258
【Inchi】
InChI=1S/C12H15N/c1-2-6-11-9(4-1)8-10-5-3-7-12(10)13-11/h1-2,4,6,10,12-13H,3,5,7-8H2/t10-,12+/m0/s1
【InChIKey】
InChIKey=FZUWGNDDOVXVGZ-CMPLNLGQSA-N
【SMILES】
c1ccc2c(c1)C[C@@H]3CCC[C@H]3N2
【MOL File】
(3AR,9AS)-REL-2,3,3A….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:1
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3AR,9AS)-REL-2,3,3A,4,9,9A-HEXAHYDRO-1H-CYCLOPENTA[B]QUINOLINE.cml