Home Nitriles 2-Bromo-4-(trifluoromethyl)phenylacetonitrile

2-Bromo-4-(trifluoromethyl)phenylacetonitrile

CAS No.:
474024-36-7
Catalog Number:
AG003GNG
Molecular Formula:
C9H5BrF3N
Molecular Weight:
264.0419
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$23
- +
5g
98%
In Stock USA
United States
$72
- +
10g
98%
In Stock USA
United States
$119
- +
25g
98%
In Stock USA
United States
$238
- +
100g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG003GNG
Chemical Name:
2-Bromo-4-(trifluoromethyl)phenylacetonitrile
CAS Number:
474024-36-7
Molecular Formula:
C9H5BrF3N
Molecular Weight:
264.0419
MDL Number:
MFCD03094308
IUPAC Name:
2-[2-bromo-4-(trifluoromethyl)phenyl]acetonitrile
InChI:
InChI=1S/C9H5BrF3N/c10-8-5-7(9(11,12)13)2-1-6(8)3-4-14/h1-2,5H,3H2
InChI Key:
RYUZTTSDBHOIAF-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(cc1Br)C(F)(F)F
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.956g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.045g/mol
Monoisotopic Mass:
262.956g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties