Home Aldehydes 2-Quinolinecarboxaldehyde, 4-hydroxy-

2-Quinolinecarboxaldehyde, 4-hydroxy-

CAS No.:
168141-99-9
Catalog Number:
AG001XVI
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
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Product Description
Catalog Number:
AG001XVI
Chemical Name:
2-Quinolinecarboxaldehyde, 4-hydroxy-
CAS Number:
168141-99-9
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
IUPAC Name:
4-oxo-1H-quinoline-2-carbaldehyde
InChI:
InChI=1S/C10H7NO2/c12-6-7-5-10(13)8-3-1-2-4-9(8)11-7/h1-6H,(H,11,13)
InChI Key:
PCPFJNLCUUEVDQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(O)c2c(n1)cccc2
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties