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80231-41-0 | 2-Hydroxy-7-methylquinoline-3-carbaldehyde
CAS No: 80231-41-0 Catalog No: AG008N8E MDL No:MFCD02239524
Product Description
Catalog Number:
AG008N8E
Chemical Name:
2-Hydroxy-7-methylquinoline-3-carbaldehyde
CAS Number:
80231-41-0
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD02239524
IUPAC Name:
7-methyl-2-oxo-1H-quinoline-3-carbaldehyde
InChI:
InChI=1S/C11H9NO2/c1-7-2-3-8-5-9(6-13)11(14)12-10(8)4-7/h2-6H,1H3,(H,12,14)
InChI Key:
CYCWXKDJRZUITF-UHFFFAOYSA-N
SMILES:
O=Cc1cc2ccc(cc2nc1O)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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