Home Nitriles 4-(3,5-Dimethylphenyl)benzonitrile

4-(3,5-Dimethylphenyl)benzonitrile

CAS No.:
935552-89-9
Catalog Number:
AG00IHO1
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$32
- +
250mg
95%
In Stock USA
United States
$55
- +
1g
95%
In Stock USA
United States
$110
- +
5g
95%
In Stock USA
United States
$328
- +
Product Description
Catalog Number:
AG00IHO1
Chemical Name:
4-(3,5-Dimethylphenyl)benzonitrile
CAS Number:
935552-89-9
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
MDL Number:
MFCD21609633
IUPAC Name:
4-(3,5-dimethylphenyl)benzonitrile
InChI:
InChI=1S/C15H13N/c1-11-7-12(2)9-15(8-11)14-5-3-13(10-16)4-6-14/h3-9H,1-2H3
InChI Key:
XRXGVDHXCUMXEW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1cc(C)cc(c1)C
Properties
Complexity:
256  
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