Home Nitriles 5-Fluoro-2-methylbenzonitrile

5-Fluoro-2-methylbenzonitrile

CAS No.:
77532-79-7
Catalog Number:
AG008OXO
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
$37
- +
100g
98%
In Stock USA
United States
$130
- +
500g
98%
In Stock USA
United States
$474
- +
Product Description
Catalog Number:
AG008OXO
Chemical Name:
5-Fluoro-2-methylbenzonitrile
CAS Number:
77532-79-7
Molecular Formula:
C8H6FN
Molecular Weight:
135.1383
MDL Number:
MFCD00042295
IUPAC Name:
5-fluoro-2-methylbenzonitrile
InChI:
InChI=1S/C8H6FN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChI Key:
IBRODYNXELBTJC-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)ccc1C
Properties
Complexity:
158  
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:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties