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Home Nitriles 2-Fluorophenylacetonitrile

2-Fluorophenylacetonitrile

CAS No.:
326-62-5
Catalog Number:
AG003HBO
Molecular Formula:
C8H6FN
Molecular Weight:
135.1383
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
Product Description
Catalog Number:
AG003HBO
Chemical Name:
2-Fluorophenylacetonitrile
CAS Number:
326-62-5
Molecular Formula:
C8H6FN
Molecular Weight:
135.1383
MDL Number:
MFCD00002197
IUPAC Name:
2-(2-fluorophenyl)acetonitrile
InChI:
InChI=1S/C8H6FN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5H2
InChI Key:
DAVJMKMVLKOQQC-UHFFFAOYSA-N
SMILES:
N#CCc1ccccc1F
EC Number:
206-313-0
NSC Number:
88280
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.048g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.141g/mol
Monoisotopic Mass:
135.048g/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  
Literature
Title Journal
[Cr(8)(PhCO(2))(16)O(4)].4CH(3)CN.2H(2)O: structural origin of magnetic anisotropy in a molecular spin cluster. Acta crystallographica. Section C, Crystal structure communications 20100901
Properties