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1011-42-3 | 7-Isoquinolinol, 1,2,3,4-tetrahydro-6-methoxy-
CAS No: 1011-42-3 Catalog No: AG0003RR MDL No:
Product Description
Catalog Number:
AG0003RR
Chemical Name:
7-Isoquinolinol, 1,2,3,4-tetrahydro-6-methoxy-
CAS Number:
1011-42-3
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
IUPAC Name:
6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol
InChI:
InChI=1S/C10H13NO2/c1-13-10-5-7-2-3-11-6-8(7)4-9(10)12/h4-5,11-12H,2-3,6H2,1H3
InChI Key:
QWWUCLLPHZUUDS-UHFFFAOYSA-N
SMILES:
COc1cc2CCNCc2cc1O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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