Pyrazinamine, 5-methoxy-


Chemical Name: Pyrazinamine, 5-methoxy-
CAS Number: 54013-07-9
Product Number: AG003GH9(AGN-PC-001QBA)
Synonyms:
MDL No: MFCD09909647
Molecular Formula: C5H7N3O
Molecular Weight: 125.1286

Identification/Properties


Properties
MP:
111°C
BP:
258.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
125.131g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
125.059g/mol
Monoisotopic Mass:
125.059g/mol
Topological Polar Surface Area:
61A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
88.3
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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