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87664-96-8 | 8-Isoquinolinamine, 1,2,3,4-tetrahydro-5,6-dimethoxy-2,3-dimethyl-
CAS No: 87664-96-8 Catalog No: AG004H6Q MDL No:
Product Description
Catalog Number:
AG004H6Q
Chemical Name:
8-Isoquinolinamine, 1,2,3,4-tetrahydro-5,6-dimethoxy-2,3-dimethyl-
CAS Number:
87664-96-8
Molecular Formula:
C13H20N2O2
Molecular Weight:
236.3101
IUPAC Name:
5,6-dimethoxy-2,3-dimethyl-3,4-dihydro-1H-isoquinolin-8-amine
InChI:
InChI=1S/C13H20N2O2/c1-8-5-9-10(7-15(8)2)11(14)6-12(16-3)13(9)17-4/h6,8H,5,7,14H2,1-4H3
InChI Key:
WEKOSOWOEKZYCH-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(c2c1CC(C)N(C2)C)N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.315g/mol
Monoisotopic Mass:
236.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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