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99878-76-9 | 4-Hydroxy-7,8-Dimethoxyquinoline
CAS No: 99878-76-9 Catalog No: AG003W3K MDL No:
Product Description
Catalog Number:
AG003W3K
Chemical Name:
4-Hydroxy-7,8-Dimethoxyquinoline
CAS Number:
99878-76-9
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
IUPAC Name:
7,8-dimethoxy-1H-quinolin-4-one
InChI:
InChI=1S/C11H11NO3/c1-14-9-4-3-7-8(13)5-6-12-10(7)11(9)15-2/h3-6H,1-2H3,(H,12,13)
InChI Key:
QKKBTCLRDAEMQB-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc2c1nccc2O
NSC Number:
382168
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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