Home Nitriles 2-(4-Bromo-2-fluorophenyl)-2-methylpropanenitrile

2-(4-Bromo-2-fluorophenyl)-2-methylpropanenitrile

CAS No.:
749928-77-6
Catalog Number:
AG00ICL8
Molecular Formula:
C10H9BrFN
Molecular Weight:
242.0876
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00ICL8
Chemical Name:
2-(4-Bromo-2-fluorophenyl)-2-methylpropanenitrile
CAS Number:
749928-77-6
Molecular Formula:
C10H9BrFN
Molecular Weight:
242.0876
MDL Number:
MFCD11846958
IUPAC Name:
2-(4-bromo-2-fluorophenyl)-2-methylpropanenitrile
InChI:
InChI=1S/C10H9BrFN/c1-10(2,6-13)8-4-3-7(11)5-9(8)12/h3-5H,1-2H3
InChI Key:
WPCTXASXKDFYBT-UHFFFAOYSA-N
SMILES:
N#CC(c1ccc(cc1F)Br)(C)C
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.99g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.091g/mol
Monoisotopic Mass:
240.99g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties