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51462-30-7 | 8-METHYL-2H-ISOQUINOLIN-3-ONE
CAS No: 51462-30-7 Catalog No: AG00E1SD MDL No:
Product Description
Catalog Number:
AG00E1SD
Chemical Name:
8-METHYL-2H-ISOQUINOLIN-3-ONE
CAS Number:
51462-30-7
IUPAC Name:
8-methyl-2H-isoquinolin-3-one
InChI:
InChI=1S/C10H9NO/c1-7-3-2-4-8-5-10(12)11-6-9(7)8/h2-6H,1H3,(H,11,12)
InChI Key:
AUIGWSLFJQAXNA-UHFFFAOYSA-N
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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