5-Pyrimidinecarboxylic acid, 4-chloro-2-methoxy-, ethyl ester


Chemical Name: 5-Pyrimidinecarboxylic acid, 4-chloro-2-methoxy-, ethyl ester
CAS Number: 65269-18-3
Product Number: AG00EIC5(AGN-PC-03USYZ)
Synonyms:
MDL No:
Molecular Formula: C8H9ClN2O3
Molecular Weight: 216.6217

Identification/Properties


Properties
MP:
26 - 28 °C
BP:
120 °C at 0.9 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
216.621g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
216.03g/mol
Monoisotopic Mass:
216.03g/mol
Topological Polar Surface Area:
61.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
203
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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