Home Nitriles 2,5-Difluorophenylacetonitrile

2,5-Difluorophenylacetonitrile

CAS No.:
69584-87-8
Catalog Number:
AG003FYH
Molecular Formula:
C8H5F2N
Molecular Weight:
153.1288
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$63
- +
100g
98%
In Stock USA
United States
$220
- +
Product Description
Catalog Number:
AG003FYH
Chemical Name:
2,5-Difluorophenylacetonitrile
CAS Number:
69584-87-8
Molecular Formula:
C8H5F2N
Molecular Weight:
153.1288
MDL Number:
MFCD00009972
IUPAC Name:
2-(2,5-difluorophenyl)acetonitrile
InChI:
InChI=1S/C8H5F2N/c9-7-1-2-8(10)6(5-7)3-4-11/h1-2,5H,3H2
InChI Key:
UIMMFRUOZOWROM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1CC#N)F
EC Number:
274-051-4
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.132g/mol
Monoisotopic Mass:
153.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties