Home Nitriles 2,3,5-Trifluorophenylacetonitrile

2,3,5-Trifluorophenylacetonitrile

CAS No.:
243666-14-0
Catalog Number:
AG00I4OQ
Molecular Formula:
C8H4F3N
Molecular Weight:
171.1193
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$157
- +
5g
98%
In Stock USA
United States
$463
- +
Product Description
Catalog Number:
AG00I4OQ
Chemical Name:
2,3,5-Trifluorophenylacetonitrile
CAS Number:
243666-14-0
Molecular Formula:
C8H4F3N
Molecular Weight:
171.1193
MDL Number:
MFCD00083546
IUPAC Name:
2-(2,3,5-trifluorophenyl)acetonitrile
InChI:
InChI=1S/C8H4F3N/c9-6-3-5(1-2-12)8(11)7(10)4-6/h3-4H,1H2
InChI Key:
FYOYNOOXHLNVNJ-UHFFFAOYSA-N
SMILES:
N#CCc1cc(F)cc(c1F)F
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.122g/mol
Monoisotopic Mass:
171.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties