71960-94-6
2,3,3A,4,5,6-HEXAHYDRO-1H-BENZ[DE]ISOQUINOLINE
Name2,3,3A,4,5,6-HEXAHYDRO-1H-BENZ[DE]ISOQUINOLINE
1Identification
【Name】
2,3,3A,4,5,6-HEXAHYDRO-1H-BENZ[DE]ISOQUINOLINE
【CAS】
【MDL】
MFCD13179574
【English Synonyms】
【Formula】
C12 H15 N
【MolWeight】
173.258
【Inchi】
InChI=1S/C12H15N/c1-3-9-4-2-6-11-8-13-7-10(5-1)12(9)11/h1,3,5,11,13H,2,4,6-8H2
【InChIKey】
InChIKey=FWXHYOOMTHUMDF-UHFFFAOYSA-N
【SMILES】
c1cc2c3c(c1)CNCC3CCC2
【MOL File】
2,3,3A,4,5,6-HEXAHYD….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:1
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3,3A,4,5,6-HEXAHYDRO-1H-BENZ[DE]ISOQUINOLINE.cml