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14179-84-1

14179-84-1 | 4-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-oxo-

CAS No: 14179-84-1 Catalog No: AG001H73 MDL No:MFCD02046626

Product Description

Catalog Number:
AG001H73
Chemical Name:
4-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-oxo-
CAS Number:
14179-84-1
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD02046626
IUPAC Name:
2-oxo-3,4-dihydro-1H-quinoline-4-carboxylic acid
InChI:
InChI=1S/C10H9NO3/c12-9-5-7(10(13)14)6-3-1-2-4-8(6)11-9/h1-4,7H,5H2,(H,11,12)(H,13,14)
InChI Key:
UFTLCDHPTBFVHE-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccccc2C(C1)C(=O)O

Properties

Complexity:
264  
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:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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