574-75-4
1-(4-HYDROXY-BENZYL)-7-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-6-OL
Name1-(4-HYDROXY-BENZYL)-7-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-6-OL
1Identification
【Name】
1-(4-HYDROXY-BENZYL)-7-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-6-OL
【CAS】
【MDL】
MFCD18073930
【English Synonyms】
【Formula】
C17 H19 N O3
【MolWeight】
285.341
【Inchi】
InChI=1S/C17H19NO3/c1-21-17-10-14-12(9-16(17)20)6-7-18-15(14)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3
【InChIKey】
InChIKey=HDQFMSLXNCGZDJ-UHFFFAOYSA-N
【SMILES】
COc1cc2c(cc1O)CCNC2Cc3ccc(cc3)O
【MOL File】
1-(4-HYDROXY-BENZYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-HYDROXY-BENZYL)-7-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-6-OL.cml