1H-Pyrazole-4-carboxamide


Chemical Name: 1H-Pyrazole-4-carboxamide
CAS Number: 437701-80-9
Product Number: AG003M0E(AGN-PC-01MK5B)
Synonyms:
MDL No: MFCD10001535
Molecular Formula: C4H5N3O
Molecular Weight: 111.1020

Identification/Properties


Properties
BP:
317.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
111.104g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
111.043g/mol
Monoisotopic Mass:
111.043g/mol
Topological Polar Surface Area:
71.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
104
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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