1H-Imidazole-2-carbonitrile


Chemical Name: 1H-Imidazole-2-carbonitrile
CAS Number: 31722-49-3
Product Number: AG00382T(AGN-PC-0JSYTL)
Synonyms:
MDL No:
Molecular Formula: C4H3N3
Molecular Weight: 93.0867

Identification/Properties


Computed Properties
Molecular Weight:
93.089g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
93.033g/mol
Monoisotopic Mass:
93.033g/mol
Topological Polar Surface Area:
52.5A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
101
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

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NMR Spectrum


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