Home Nitriles 4-Bromo-2-methylbenzonitrile

4-Bromo-2-methylbenzonitrile

CAS No.:
67832-11-5
Catalog Number:
AG0033XO
Molecular Formula:
C8H6BrN
Molecular Weight:
196.0439
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
10g
≥98%
In Stock USA
United States
$41
- +
25g
98%
In Stock USA
United States
$75
- +
100g
98%
In Stock USA
United States
$157
- +
500g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0033XO
Chemical Name:
4-Bromo-2-methylbenzonitrile
CAS Number:
67832-11-5
Molecular Formula:
C8H6BrN
Molecular Weight:
196.0439
MDL Number:
MFCD00041461
IUPAC Name:
4-bromo-2-methylbenzonitrile
InChI:
InChI=1S/C8H6BrN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,1H3
InChI Key:
LPEBMDFRIKYFCF-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1C)Br
NSC Number:
229305
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