Home Nitriles 2-Bromo-4-fluoro-6-methylbenzonitrile

2-Bromo-4-fluoro-6-methylbenzonitrile

CAS No.:
916792-09-1
Catalog Number:
AG00GUM4
Molecular Formula:
C8H5BrFN
Molecular Weight:
214.0344
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
10g
98%
In Stock USA
United States
$138
- +
25g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG00GUM4
Chemical Name:
2-Bromo-4-fluoro-6-methylbenzonitrile
CAS Number:
916792-09-1
Molecular Formula:
C8H5BrFN
Molecular Weight:
214.0344
MDL Number:
MFCD07782071
IUPAC Name:
2-bromo-4-fluoro-6-methylbenzonitrile
InChI:
InChI=1S/C8H5BrFN/c1-5-2-6(10)3-8(9)7(5)4-11/h2-3H,1H3
InChI Key:
JHKAGGIPLGOTCY-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cc(cc1Br)F
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.959g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.037g/mol
Monoisotopic Mass:
212.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties