Home Nitriles 4-Bromo-3-fluoro-2-methylbenzonitrile

4-Bromo-3-fluoro-2-methylbenzonitrile

CAS No.:
1349716-12-6
Catalog Number:
AG01B500
Molecular Formula:
C8H5BrFN
Molecular Weight:
214.0344
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$552
- +
1g
98%
1 week
United States
$1066
- +
5g
98%
1 week
United States
$3100
- +
25g
98%
1 week
United States
$12260
- +
Product Description
Catalog Number:
AG01B500
Chemical Name:
4-Bromo-3-fluoro-2-methylbenzonitrile
CAS Number:
1349716-12-6
Molecular Formula:
C8H5BrFN
Molecular Weight:
214.0344
MDL Number:
MFCD18917159
IUPAC Name:
4-bromo-3-fluoro-2-methylbenzonitrile
InChI:
InChI=1S/C8H5BrFN/c1-5-6(4-11)2-3-7(9)8(5)10/h2-3H,1H3
InChI Key:
ATWKXXGBCZWOCX-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1C)F)Br
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