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123497-83-6 | 2(1H)-Quinolinone, 3,4-dimethoxy-1-methyl-
CAS No: 123497-83-6 Catalog No: AG000KOE MDL No:
Product Description
Catalog Number:
AG000KOE
Chemical Name:
2(1H)-Quinolinone, 3,4-dimethoxy-1-methyl-
CAS Number:
123497-83-6
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
IUPAC Name:
3,4-dimethoxy-1-methylquinolin-2-one
InChI:
InChI=1S/C12H13NO3/c1-13-9-7-5-4-6-8(9)10(15-2)11(16-3)12(13)14/h4-7H,1-3H3
InChI Key:
FJUGNBUBFFDDGK-UHFFFAOYSA-N
SMILES:
COc1c(OC)c(=O)n(c2c1cccc2)C
Properties
Complexity:
324
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:
0
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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