Home Carboxys 5-Quinolinecarboxylic acid, 8-hydroxy-, ethyl ester

5-Quinolinecarboxylic acid, 8-hydroxy-, ethyl ester

CAS No.:
104293-76-7
Catalog Number:
AG00HABP
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
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Product Description
Catalog Number:
AG00HABP
Chemical Name:
5-Quinolinecarboxylic acid, 8-hydroxy-, ethyl ester
CAS Number:
104293-76-7
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
ethyl 8-hydroxyquinoline-5-carboxylate
InChI:
InChI=1S/C12H11NO3/c1-2-16-12(15)9-5-6-10(14)11-8(9)4-3-7-13-11/h3-7,14H,2H2,1H3
InChI Key:
LYFNAHDRMCPGLF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c2c1cccn2)O
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties