Home Halogens 4-Bromo-3-(bromomethyl)benzonitrile

4-Bromo-3-(bromomethyl)benzonitrile

CAS No.:
190197-86-5
Catalog Number:
AG002EDT
Molecular Formula:
C8H5Br2N
Molecular Weight:
274.9400
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$100
- +
1g
98%
In Stock USA
United States
$207
- +
5g
98%
In Stock USA
United States
$657
- +
10g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG002EDT
Chemical Name:
4-Bromo-3-(bromomethyl)benzonitrile
CAS Number:
190197-86-5
Molecular Formula:
C8H5Br2N
Molecular Weight:
274.9400
MDL Number:
MFCD12755973
IUPAC Name:
4-bromo-3-(bromomethyl)benzonitrile
InChI:
InChI=1S/C8H5Br2N/c9-4-7-3-6(5-11)1-2-8(7)10/h1-3H,4H2
InChI Key:
AEXYSQSKOJJWLK-UHFFFAOYSA-N
SMILES:
BrCc1cc(C#N)ccc1Br
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.877g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.943g/mol
Monoisotopic Mass:
272.879g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties