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4602-73-7 | 6-Methoxy-7-hydroxy-3,4-dihydroisoquinoline
CAS No: 4602-73-7 Catalog No: AG003NFL MDL No:MFCD00143517
Product Description
Catalog Number:
AG003NFL
Chemical Name:
6-Methoxy-7-hydroxy-3,4-dihydroisoquinoline
CAS Number:
4602-73-7
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD00143517
IUPAC Name:
6-methoxy-3,4-dihydroisoquinolin-7-ol
InChI:
InChI=1S/C10H11NO2/c1-13-10-5-7-2-3-11-6-8(7)4-9(10)12/h4-6,12H,2-3H2,1H3
InChI Key:
UQBWYWCIBNWMPI-UHFFFAOYSA-N
SMILES:
COc1cc2CCN=Cc2cc1O
UNII:
6NSL0GBQ6T
NSC Number:
627589
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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