Pyrazinecarboxylic acid, 5-chloro-6-methyl-, methyl ester


Chemical Name: Pyrazinecarboxylic acid, 5-chloro-6-methyl-, methyl ester
CAS Number: 77168-85-5
Product Number: AG0036MK(AGN-PC-0NJMX5)
Synonyms:
MDL No:
Molecular Formula: C7H7ClN2O2
Molecular Weight: 186.5957

Identification/Properties


Properties
MP:
40-43℃
BP:
260℃
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
186.595g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
186.02g/mol
Monoisotopic Mass:
186.02g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
177
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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