53921-73-6
1,2,3,7,8,8A-HEXAHYDRO-CYCLOPENT[IJ]ISOQUINOLINE
Name1,2,3,7,8,8A-HEXAHYDRO-CYCLOPENT[IJ]ISOQUINOLINE
1Identification
【Name】
1,2,3,7,8,8A-HEXAHYDRO-CYCLOPENT[IJ]ISOQUINOLINE
【CAS】
【MDL】
MFCD06254710
【English Synonyms】
【Formula】
C11 H13 N
【MolWeight】
159.231
【Inchi】
InChI=1S/C11H13N/c1-2-8-4-5-10-11(8)9(3-1)6-7-12-10/h1-3,10,12H,4-7H2
【InChIKey】
InChIKey=DERXXZAOHFJKSL-UHFFFAOYSA-N
【SMILES】
c1cc2c3c(c1)CCNC3CC2
【MOL File】
1,2,3,7,8,8A-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
1,2,3,7,8,8A-HEXAHYDRO-CYCLOPENT[IJ]ISOQUINOLINE.cml