881686-34-6
3-(6,7-DIMETHOXY-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-PROPIONIC ACID HYDROCHLORIDE
Name3-(6,7-DIMETHOXY-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-PROPIONIC ACID HYDROCHLORIDE
FormulaC14 H19 N O4 . Cl H
1Identification
【Name】
3-(6,7-DIMETHOXY-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-PROPIONIC ACID HYDROCHLORIDE
【CAS】
【MDL】
MFCD00573768
【English Synonyms】
【Formula】
C14 H19 N O4 . Cl H
【MolWeight】
301.768
【Inchi】
InChI=1S/C14H19NO4.ClH/c1-18-12-7-10-3-5-15(6-4-14(16)17)9-11(10)8-13(12)19-2;/h7-8H,3-6,9H2,1-2H3,(H,16,17);1H
【InChIKey】
InChIKey=VVWDYCVQPIYAFY-UHFFFAOYSA-N
【SMILES】
COc1cc2c(cc1OC)CN(CC2)CCC(=O)O.Cl
【MOL File】
3-(6,7-DIMETHOXY-3,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(6,7-DIMETHOXY-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-PROPIONIC ACID HYDROCHLORIDE.cml