3-Quinolinecarboxylic acid, 4-hydroxy-7-methoxy-, ethyl ester


Chemical Name: 3-Quinolinecarboxylic acid, 4-hydroxy-7-methoxy-, ethyl ester
CAS Number: 63463-15-0
Product Number: AG00E8V3(AGN-PC-0OE7G5)
Synonyms:
MDL No: MFCD00085986
Molecular Formula: C13H13NO4
Molecular Weight: 247.2466

Identification/Properties


Properties
MP:
275 °C
BP:
373.2±37.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
247.25g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
247.084g/mol
Monoisotopic Mass:
247.084g/mol
Topological Polar Surface Area:
64.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
377
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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