Home Nitriles 4'-Propyl-[1,1'-biphenyl]-4-carbonitrile

4'-Propyl-[1,1'-biphenyl]-4-carbonitrile

CAS No.:
58743-76-3
Catalog Number:
AG003L92
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>99.0%(GC)
1 week
United States
$112
- +
5g
>99.0%(GC)
1 week
United States
$225
- +
Product Description
Catalog Number:
AG003L92
Chemical Name:
4'-Propyl-[1,1'-biphenyl]-4-carbonitrile
CAS Number:
58743-76-3
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
MDL Number:
MFCD00505987
IUPAC Name:
4-(4-propylphenyl)benzonitrile
InChI:
InChI=1S/C16H15N/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(12-17)7-11-16/h4-11H,2-3H2,1H3
InChI Key:
XFMPTZWVMVMELB-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)c1ccc(cc1)C#N
EC Number:
261-415-2
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.12g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.303g/mol
Monoisotopic Mass:
221.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties