897035-07-3
1-(2-HYDROXYNAPHTH-1-YL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
Name1-(2-HYDROXYNAPHTH-1-YL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
1Identification
【Name】
1-(2-HYDROXYNAPHTH-1-YL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
【CAS】
【MDL】
MFCD11505089
【English Synonyms】
【Formula】
C21 H21 N O3
【MolWeight】
335.401
【Inchi】
InChI=1S/C21H21NO3/c1-24-18-11-14-9-10-22-21(16(14)12-19(18)25-2)20-15-6-4-3-5-13(15)7-8-17(20)23/h3-8,11-12,21-23H,9-10H2,1-2H3
【InChIKey】
InChIKey=HKLKGEIEZNATJU-UHFFFAOYSA-N
【SMILES】
COc1cc2c(cc1OC)C(NCC2)c3c4ccccc4ccc3O
【MOL File】
1-(2-HYDROXYNAPHTH-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-HYDROXYNAPHTH-1-YL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE.cml