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69601-46-3 | 6-Hydroxy-1-methyl-3,4-dihydroquinolin-2(1H)-one
CAS No: 69601-46-3 Catalog No: AG005WB7 MDL No:
Product Description
Catalog Number:
AG005WB7
Chemical Name:
6-Hydroxy-1-methyl-3,4-dihydroquinolin-2(1H)-one
CAS Number:
69601-46-3
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
IUPAC Name:
6-hydroxy-1-methyl-3,4-dihydroquinolin-2-one
InChI:
InChI=1S/C10H11NO2/c1-11-9-4-3-8(12)6-7(9)2-5-10(11)13/h3-4,6,12H,2,5H2,1H3
InChI Key:
XCXDDKNPUFGHKD-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CCC(=O)N2C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/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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