Home Nitriles 4-Fluoro-3-methylphenylacetonitrile

4-Fluoro-3-methylphenylacetonitrile

CAS No.:
1000548-41-3
Catalog Number:
AG009OUT
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$49
- +
5g
95%
In Stock USA
United States
$173
- +
Product Description
Catalog Number:
AG009OUT
Chemical Name:
4-Fluoro-3-methylphenylacetonitrile
CAS Number:
1000548-41-3
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
MDL Number:
MFCD09832240
IUPAC Name:
2-(4-fluoro-3-methylphenyl)acetonitrile
InChI:
InChI=1S/C9H8FN/c1-7-6-8(4-5-11)2-3-9(7)10/h2-3,6H,4H2,1H3
InChI Key:
XAVNYICMRHFCLO-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(c(c1)C)F
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.168g/mol
Monoisotopic Mass:
149.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties