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113961-91-4 | 2(1H)-Quinolinone, 3,4-dihydro-1-hydroxy-6-methoxy-
CAS No: 113961-91-4 Catalog No: AG000A67 MDL No:
Product Description
Catalog Number:
AG000A67
Chemical Name:
2(1H)-Quinolinone, 3,4-dihydro-1-hydroxy-6-methoxy-
CAS Number:
113961-91-4
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
IUPAC Name:
1-hydroxy-6-methoxy-3,4-dihydroquinolin-2-one
InChI:
InChI=1S/C10H11NO3/c1-14-8-3-4-9-7(6-8)2-5-10(12)11(9)13/h3-4,6,13H,2,5H2,1H3
InChI Key:
IKXYBAQYMDBQEY-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)CCC(=O)N2O
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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