Home Nitriles 3-Ethyl-4-fluorobenzonitrile

3-Ethyl-4-fluorobenzonitrile

CAS No.:
869299-63-8
Catalog Number:
AG003JEI
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥95%
In Stock USA
United States
$123
- +
5g
95%
In Stock USA
United States
$317
- +
Product Description
Catalog Number:
AG003JEI
Chemical Name:
3-Ethyl-4-fluorobenzonitrile
CAS Number:
869299-63-8
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
MDL Number:
MFCD19441199
IUPAC Name:
3-ethyl-4-fluorobenzonitrile
InChI:
InChI=1S/C9H8FN/c1-2-8-5-7(6-11)3-4-9(8)10/h3-5H,2H2,1H3
InChI Key:
RFLBKVBNVUDWDP-UHFFFAOYSA-N
SMILES:
CCc1cc(C#N)ccc1F
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:
2.5  
Properties