Home Nitros 2-Bromo-3,5-dinitrobenzoic acid

2-Bromo-3,5-dinitrobenzoic acid

CAS No.:
116529-60-3
Catalog Number:
AG000CPK
Molecular Formula:
C7H3BrN2O6
Molecular Weight:
291.0125
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$50
- +
25g
97%
In Stock USA
United States
$169
- +
100g
97%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG000CPK
Chemical Name:
2-Bromo-3,5-dinitrobenzoic acid
CAS Number:
116529-60-3
Molecular Formula:
C7H3BrN2O6
Molecular Weight:
291.0125
MDL Number:
MFCD00458630
IUPAC Name:
2-bromo-3,5-dinitrobenzoic acid
InChI:
InChI=1S/C7H3BrN2O6/c8-6-4(7(11)12)1-3(9(13)14)2-5(6)10(15)16/h1-2H,(H,11,12)
InChI Key:
BBKJKUFARRJPRP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)O)c(c(c1)[N+](=O)[O-])Br
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.917g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.013g/mol
Monoisotopic Mass:
289.917g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties