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Home Nitros 2-Bromo-5-nitrobenzoic acid

2-Bromo-5-nitrobenzoic acid

CAS No.:
943-14-6
Catalog Number:
AG006BYX
Molecular Formula:
C7H4BrNO4
Molecular Weight:
246.0150
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$16
- +
5g
98%
In Stock USA
United States
$36
- +
25g
98%
In Stock USA
United States
$81
- +
100g
98%
In Stock USA
United States
$238
- +
500g
98%
In Stock USA
United States
$988
- +
Product Description
Catalog Number:
AG006BYX
Chemical Name:
2-Bromo-5-nitrobenzoic acid
CAS Number:
943-14-6
Molecular Formula:
C7H4BrNO4
Molecular Weight:
246.0150
MDL Number:
MFCD00134558
IUPAC Name:
2-bromo-5-nitrobenzoic acid
InChI:
InChI=1S/C7H4BrNO4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,(H,10,11)
InChI Key:
UVFWYVCDRKRAJH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)C(=O)O)Br
NSC Number:
52211
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:
2.1  
Literature
Title Journal
Diastereo- and enantioselective hydrogenative aldol coupling of vinyl ketones: design of effective monodentate TADDOL-like phosphonite ligands. Journal of the American Chemical Society 20080305
Properties