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1245645-02-6 | 6-Quinolinecarboxylic acid, 1,4-dihydro-2-hydroxy-
CAS No: 1245645-02-6 Catalog No: AG000M9Q MDL No:
Product Description
Catalog Number:
AG000M9Q
Chemical Name:
6-Quinolinecarboxylic acid, 1,4-dihydro-2-hydroxy-
CAS Number:
1245645-02-6
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
IUPAC Name:
2-hydroxy-1,4-dihydroquinoline-6-carboxylic acid
InChI:
InChI=1S/C10H9NO3/c12-9-4-2-6-5-7(10(13)14)1-3-8(6)11-9/h1,3-5,11-12H,2H2,(H,13,14)
InChI Key:
KJJXETJEQGYNIB-UHFFFAOYSA-N
SMILES:
OC1=CCc2c(N1)ccc(c2)C(=O)O
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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