Benzenamine, 4-(1H-pyrazol-4-yl)-


Chemical Name: Benzenamine, 4-(1H-pyrazol-4-yl)-
CAS Number: 114474-28-1
Product Number: AG000EHK(AGN-PC-00006H)
Synonyms:
MDL No:
Molecular Formula: C9H9N3
Molecular Weight: 159.1879

Identification/Properties


Computed Properties
Molecular Weight:
159.192g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
159.08g/mol
Monoisotopic Mass:
159.08g/mol
Topological Polar Surface Area:
54.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
141
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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