[1,1'-Biphenyl]-4-carbonitrile


Chemical Name: [1,1'-Biphenyl]-4-carbonitrile
CAS Number: 2920-38-9
Product Number: AG002XO7(AGN-PC-0JKDTT)
Synonyms:
MDL No:
Molecular Formula: C13H9N
Molecular Weight: 179.2173

Identification/Properties


Properties
MP:
85-87 °C(lit.)
BP:
332.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.7270 (estimate)
Computed Properties
Molecular Weight:
179.222g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
179.073g/mol
Monoisotopic Mass:
179.073g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
211
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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