3-amino-1-cyclopentylpyrazole-4-carbonitrile


Chemical Name: 3-amino-1-cyclopentylpyrazole-4-carbonitrile
CAS Number: 122799-98-8
Product Number: AG000JI6(AGN-PC-001WRC)
Synonyms:
MDL No:
Molecular Formula: C9H12N4
Molecular Weight: 176.2184

Identification/Properties


Computed Properties
Molecular Weight:
176.223g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
176.106g/mol
Monoisotopic Mass:
176.106g/mol
Topological Polar Surface Area:
67.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
225
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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