Home Nitriles 5-Bromo-2-methylbenzonitrile

5-Bromo-2-methylbenzonitrile

CAS No.:
156001-51-3
Catalog Number:
AG001OGL
Molecular Formula:
C8H6BrN
Molecular Weight:
196.0439
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$32
- +
25g
>97%
In Stock USA
United States
$96
- +
100g
98%
In Stock USA
United States
$338
- +
500g
98%
In Stock USA
United States
$1013
- +
Product Description
Catalog Number:
AG001OGL
Chemical Name:
5-Bromo-2-methylbenzonitrile
CAS Number:
156001-51-3
Molecular Formula:
C8H6BrN
Molecular Weight:
196.0439
MDL Number:
MFCD08061920
IUPAC Name:
5-bromo-2-methylbenzonitrile
InChI:
InChI=1S/C8H6BrN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChI Key:
WNVUTFDOGUGEIS-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)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:
194.968g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.047g/mol
Monoisotopic Mass:
194.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties