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

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

CAS No.:
52709-83-8
Catalog Number:
AG003LTI
Molecular Formula:
C17H17N
Molecular Weight:
235.3236
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week
United States
$182
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Product Description
Catalog Number:
AG003LTI
Chemical Name:
4'-Butyl-[1,1'-biphenyl]-4-carbonitrile
CAS Number:
52709-83-8
Molecular Formula:
C17H17N
Molecular Weight:
235.3236
MDL Number:
MFCD00506009
IUPAC Name:
4-(4-butylphenyl)benzonitrile
InChI:
InChI=1S/C17H17N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h5-12H,2-4H2,1H3
InChI Key:
PJPLBHHDTUICNN-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)c1ccc(cc1)C#N
EC Number:
258-119-0
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.136g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.33g/mol
Monoisotopic Mass:
235.136g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties