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259214-73-8

259214-73-8 | 2-Quinolinecarboxylic acid, 4-hydroxy-7-methoxy-, methyl ester

CAS No: 259214-73-8 Catalog No: AG002R2N MDL No:

Product Description

Catalog Number:
AG002R2N
Chemical Name:
2-Quinolinecarboxylic acid, 4-hydroxy-7-methoxy-, methyl ester
CAS Number:
259214-73-8
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
IUPAC Name:
methyl 7-methoxy-4-oxo-1H-quinoline-2-carboxylate
InChI:
InChI=1S/C12H11NO4/c1-16-7-3-4-8-9(5-7)13-10(6-11(8)14)12(15)17-2/h3-6H,1-2H3,(H,13,14)
InChI Key:
MUJXVVHLAUTTHP-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)nc(cc2O)C(=O)OC

Properties

Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.223g/mol
Monoisotopic Mass:
233.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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