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Home Nitros Sodium 3-nitrobenzoate

Sodium 3-nitrobenzoate

CAS No.:
827-95-2
Catalog Number:
AG003UB6
Molecular Formula:
C7H4NNaO4
Molecular Weight:
189.1007
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%(HPLC)
In Stock USA
United States
$39
- +
25g
98%(HPLC)
In Stock USA
United States
$46
- +
100g
98%(HPLC)
In Stock USA
United States
$80
- +
500g
98%(HPLC)
In Stock USA
United States
$204
- +
Product Description
Catalog Number:
AG003UB6
Chemical Name:
Sodium 3-nitrobenzoate
CAS Number:
827-95-2
Molecular Formula:
C7H4NNaO4
Molecular Weight:
189.1007
MDL Number:
MFCD00051097
IUPAC Name:
sodium;3-nitrobenzoate
InChI:
InChI=1S/C7H5NO4.Na/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10);/q;+1/p-1
InChI Key:
MUADFEZFSKAZLT-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1cccc(c1)[N+](=O)[O-].[Na+]
EC Number:
212-578-3
UNII:
I1EQ837B3J
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.102g/mol
Monoisotopic Mass:
189.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Influence of alkaline earth metals on molecular structure of 3-nitrobenzoic acid in comparison with alkali metals effect. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20111101
Direct generation of acyclic polypropionate stereopolyads via double diastereo- and enantioselective iridium-catalyzed crotylation of 1,3-diols: beyond stepwise carbonyl addition in polyketide construction. Journal of the American Chemical Society 20110817
CdSe quantum dots capped PAMAM dendrimer nanocomposites for sensing nitroaromatic compounds. Talanta 20110215
Mitochondrial-dependent apoptosis in Huntington's disease human cybrids. Experimental neurology 20100401
Effect of long-term exposure, biogenic substrate presence, and electron acceptor conditions on the biodegradation of multiple substituted benzoates and phenolates. Water research 20050901
Biomass characteristics in three sequencing batch reactors treating a wastewater containing synthetic organic chemicals. Water research 20050201
Properties