Home Nitriles 3-(3-Fluoro-4-methylphenyl)benzonitrile

3-(3-Fluoro-4-methylphenyl)benzonitrile

CAS No.:
1352318-43-4
Catalog Number:
AG006ZAM
Molecular Formula:
C14H10FN
Molecular Weight:
211.2343
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG006ZAM
Chemical Name:
3-(3-Fluoro-4-methylphenyl)benzonitrile
CAS Number:
1352318-43-4
Molecular Formula:
C14H10FN
Molecular Weight:
211.2343
MDL Number:
MFCD20529480
IUPAC Name:
3-(3-fluoro-4-methylphenyl)benzonitrile
InChI:
InChI=1S/C14H10FN/c1-10-5-6-13(8-14(10)15)12-4-2-3-11(7-12)9-16/h2-8H,1H3
InChI Key:
AGTSDCJWBCGXRP-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1ccc(c(c1)F)C
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.239g/mol
Monoisotopic Mass:
211.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties