251646-41-0
(4AR,9BS)-2,3,4,4A,5,9B-HEXAHYDRO-2,8-DIMETHYL-1H-PYRIDO[4,3-B]INDOLE
Name(4AR,9BS)-2,3,4,4A,5,9B-HEXAHYDRO-2,8-DIMETHYL-1H-PYRIDO[4,3-B]INDOLE
1Identification
【Name】
(4AR,9BS)-2,3,4,4A,5,9B-HEXAHYDRO-2,8-DIMETHYL-1H-PYRIDO[4,3-B]INDOLE
【CAS】
【MDL】
MFCD11519106
【English Synonyms】
【Formula】
C13 H18 N2
【MolWeight】
202.299
【Inchi】
InChI=1S/C13H18N2/c1-9-3-4-12-10(7-9)11-8-15(2)6-5-13(11)14-12/h3-4,7,11,13-14H,5-6,8H2,1-2H3/t11-,13-/m1/s1
【InChIKey】
InChIKey=CYJQCYXRNNCURD-DGCLKSJQSA-N
【SMILES】
Cc1ccc2c(c1)[C@H]3CN(CC[C@H]3N2)C
【MOL File】
(4AR,9BS)-2,3,4,4A,5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(4AR,9BS)-2,3,4,4A,5,9B-HEXAHYDRO-2,8-DIMETHYL-1H-PYRIDO[4,3-B]INDOLE.cml