Home Nitriles 3-(3,5-Dimethylphenyl)benzonitrile

3-(3,5-Dimethylphenyl)benzonitrile

CAS No.:
713079-19-7
Catalog Number:
AG005VSY
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG005VSY
Chemical Name:
3-(3,5-Dimethylphenyl)benzonitrile
CAS Number:
713079-19-7
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
MDL Number:
MFCD19316255
IUPAC Name:
3-(3,5-dimethylphenyl)benzonitrile
InChI:
InChI=1S/C15H13N/c1-11-6-12(2)8-15(7-11)14-5-3-4-13(9-14)10-16/h3-9H,1-2H3
InChI Key:
QBYQOHMDGQMIQB-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cc(C)cc(c1)C
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.276g/mol
Monoisotopic Mass:
207.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties