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1105195-56-9 | 5-HYDROXY-2-(2-METHOXYETHYL)ISOQUINOLIN-1(2H)-ONE
CAS No: 1105195-56-9 Catalog No: AG01AQDJ MDL No:MFCD16652881
Product Description
Catalog Number:
AG01AQDJ
Chemical Name:
5-HYDROXY-2-(2-METHOXYETHYL)ISOQUINOLIN-1(2H)-ONE
CAS Number:
1105195-56-9
MDL Number:
MFCD16652881
IUPAC Name:
5-hydroxy-2-(2-methoxyethyl)isoquinolin-1-one
InChI:
InChI=1S/C12H13NO3/c1-16-8-7-13-6-5-9-10(12(13)15)3-2-4-11(9)14/h2-6,14H,7-8H2,1H3
InChI Key:
LOBLSHPGHMIEFP-UHFFFAOYSA-N
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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