3-Quinolinecarboxylic acid, 1,4-dihydro-4-oxo-


Chemical Name: 3-Quinolinecarboxylic acid, 1,4-dihydro-4-oxo-
CAS Number: 13721-01-2
Product Number: AG0012XU(AGN-PC-0JNAHV)
Synonyms:
MDL No: MFCD00498984
Molecular Formula: C10H7NO3
Molecular Weight: 189.1675

Identification/Properties


Properties
MP:
269-270℃
BP:
358.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
189.17g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
189.043g/mol
Monoisotopic Mass:
189.043g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
309
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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