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116526-30-8 | 2-Hydroxy-3,4-dihydroisoquinolin-1(2H)-one
CAS No: 116526-30-8 Catalog No: AG01DZRO MDL No:
Product Description
Catalog Number:
AG01DZRO
Chemical Name:
2-Hydroxy-3,4-dihydroisoquinolin-1(2H)-one
CAS Number:
116526-30-8
IUPAC Name:
2-hydroxy-3,4-dihydroisoquinolin-1-one
InChI:
InChI=1S/C9H9NO2/c11-9-8-4-2-1-3-7(8)5-6-10(9)12/h1-4,12H,5-6H2
InChI Key:
MFBKBTMVISFSOJ-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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