Pyrazinecarboxylic acid, 5-methyl-, ethyl ester


Chemical Name: Pyrazinecarboxylic acid, 5-methyl-, ethyl ester
CAS Number: 41110-34-3
Product Number: AG0073C0(AGN-PC-00TXFS)
Synonyms:
MDL No:
Molecular Formula: C8H10N2O2
Molecular Weight: 166.1772

Identification/Properties


Computed Properties
Molecular Weight:
166.18g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
166.074g/mol
Monoisotopic Mass:
166.074g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
161
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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