Home Nitros 3-Bromo-4-nitrobenzoic acid

3-Bromo-4-nitrobenzoic acid

CAS No.:
101420-81-9
Catalog Number:
AG0004H1
Molecular Formula:
C7H4BrNO4
Molecular Weight:
246.0150
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$90
- +
5g
95%
In Stock USA
United States
$275
- +
25g
95%
In Stock USA
United States
$838
- +
Product Description
Catalog Number:
AG0004H1
Chemical Name:
3-Bromo-4-nitrobenzoic acid
CAS Number:
101420-81-9
Molecular Formula:
C7H4BrNO4
Molecular Weight:
246.0150
MDL Number:
MFCD04117949
IUPAC Name:
3-bromo-4-nitrobenzoic acid
InChI:
InChI=1S/C7H4BrNO4/c8-5-3-4(7(10)11)1-2-6(5)9(12)13/h1-3H,(H,10,11)
InChI Key:
KKPPNEJUUOQRLE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)Br)[N+](=O)[O-]
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.932g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.016g/mol
Monoisotopic Mass:
244.932g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties