Home Nitriles 2-(Trifluoromethoxy)phenylacetonitrile

2-(Trifluoromethoxy)phenylacetonitrile

CAS No.:
137218-25-8
Catalog Number:
AG0012YE
Molecular Formula:
C9H6F3NO
Molecular Weight:
201.1452
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>95.0%(GC)
1 week
United States
$67
- +
Product Description
Catalog Number:
AG0012YE
Chemical Name:
2-(Trifluoromethoxy)phenylacetonitrile
CAS Number:
137218-25-8
Molecular Formula:
C9H6F3NO
Molecular Weight:
201.1452
MDL Number:
MFCD16295036
IUPAC Name:
2-[2-(trifluoromethoxy)phenyl]acetonitrile
InChI:
InChI=1S/C9H6F3NO/c10-9(11,12)14-8-4-2-1-3-7(8)5-6-13/h1-4H,5H2
InChI Key:
OIKWCWVMUBCXJM-UHFFFAOYSA-N
SMILES:
N#CCc1ccccc1OC(F)(F)F
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.148g/mol
Monoisotopic Mass:
201.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties