Home Nitriles 5-Bromo-2-nitrobenzonitrile

5-Bromo-2-nitrobenzonitrile

CAS No.:
89642-50-2
Catalog Number:
AG003W38
Molecular Formula:
C7H3BrN2O2
Molecular Weight:
227.0149
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$38
- +
5g
97%
In Stock USA
United States
$132
- +
10g
97%
In Stock USA
United States
$207
- +
25g
97%
In Stock USA
United States
$407
- +
Product Description
Catalog Number:
AG003W38
Chemical Name:
5-Bromo-2-nitrobenzonitrile
CAS Number:
89642-50-2
Molecular Formula:
C7H3BrN2O2
Molecular Weight:
227.0149
MDL Number:
MFCD10699674
IUPAC Name:
5-bromo-2-nitrobenzonitrile
InChI:
InChI=1S/C7H3BrN2O2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H
InChI Key:
LCNNOEPOXHHUQG-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)ccc1[N+](=O)[O-]
NSC Number:
263787
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