Home Nitriles 2-Chloro-4-[3-(trifluoromethyl)phenyl]benzonitrile

2-Chloro-4-[3-(trifluoromethyl)phenyl]benzonitrile

CAS No.:
154606-29-8
Catalog Number:
AG007XGD
Molecular Formula:
C14H7ClF3N
Molecular Weight:
281.6603
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG007XGD
Chemical Name:
2-Chloro-4-[3-(trifluoromethyl)phenyl]benzonitrile
CAS Number:
154606-29-8
Molecular Formula:
C14H7ClF3N
Molecular Weight:
281.6603
MDL Number:
MFCD18424188
IUPAC Name:
2-chloro-4-[3-(trifluoromethyl)phenyl]benzonitrile
InChI:
InChI=1S/C14H7ClF3N/c15-13-7-10(4-5-11(13)8-19)9-2-1-3-12(6-9)14(16,17)18/h1-7H
InChI Key:
OUGRGYSIYSKCNB-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Cl)c1cccc(c1)C(F)(F)F
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.022g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.662g/mol
Monoisotopic Mass:
281.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties