Home Nitriles 4-Bromo-2-nitrobenzonitrile

4-Bromo-2-nitrobenzonitrile

CAS No.:
79603-03-5
Catalog Number:
AG0051A2
Molecular Formula:
C7H3BrN2O2
Molecular Weight:
227.0149
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$44
- +
5g
98%
In Stock USA
United States
$138
- +
10g
98%
In Stock USA
United States
$263
- +
25g
98%
In Stock USA
United States
$525
- +
100g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG0051A2
Chemical Name:
4-Bromo-2-nitrobenzonitrile
CAS Number:
79603-03-5
Molecular Formula:
C7H3BrN2O2
Molecular Weight:
227.0149
MDL Number:
MFCD00087225
IUPAC Name:
4-bromo-2-nitrobenzonitrile
InChI:
InChI=1S/C7H3BrN2O2/c8-6-2-1-5(4-9)7(3-6)10(11)12/h1-3H
InChI Key:
IOBYLOUUUJPZEO-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1[N+](=O)[O-])Br
NSC Number:
158356
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.938g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.017g/mol
Monoisotopic Mass:
225.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties