4-Pyridineacetic acid, methyl ester


Chemical Name: 4-Pyridineacetic acid, methyl ester
CAS Number: 29800-89-3
Product Number: AG003RW7(AGN-PC-0JLNYK)
Synonyms:
MDL No: MFCD00972014
Molecular Formula: C8H9NO2
Molecular Weight: 151.1626

Identification/Properties


Properties
MP:
8-8.5 °C(lit.);
BP:
235.3°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.512(lit.)
Computed Properties
Molecular Weight:
151.165g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
151.063g/mol
Monoisotopic Mass:
151.063g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
130
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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