Home Nitriles 3-(3-Acetylphenyl)benzonitrile

3-(3-Acetylphenyl)benzonitrile

CAS No.:
893734-99-1
Catalog Number:
AG003XB3
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003XB3
Chemical Name:
3-(3-Acetylphenyl)benzonitrile
CAS Number:
893734-99-1
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
MDL Number:
MFCD06802013
IUPAC Name:
3-(3-acetylphenyl)benzonitrile
InChI:
InChI=1S/C15H11NO/c1-11(17)13-5-3-7-15(9-13)14-6-2-4-12(8-14)10-16/h2-9H,1H3
InChI Key:
UVCNSNUNWCEGPT-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cccc(c1)C(=O)C
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.084g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.259g/mol
Monoisotopic Mass:
221.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties