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827-95-2,MFCD00051097
Catalog No.:AA003U8E

827-95-2 | Sodium 3-nitrobenzoate

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25g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003U8E
Chemical Name:
Sodium 3-nitrobenzoate
CAS Number:
827-95-2
Molecular Formula:
C7H4NNaO4
Molecular Weight:
189.1007
MDL Number:
MFCD00051097
SMILES:
[O-]C(=O)c1cccc(c1)[N+](=O)[O-].[Na+]
Properties
Properties
 
BP:
297.8°C at 760 mmHg  
Form:
Solid  
MP:
>300℃  
Storage:
2-8℃;Inert atmosphere;  

Computed Properties
 
Complexity:
193  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  

Downstream Synthesis Route

[1]Morozov,A.A.[JournalofOrganicChemistryUSSR(EnglishTranslation),1988,vol.24,#6,p.1138-1143][ZhurnalOrganicheskoiKhimii,1988,vol.24,#6,p.1264-1270]

[1]Kevill,DennisN.;Knauss,DonaldC.[JournaloftheChemicalSociety.PerkintransactionsII,1993,#3,p.307-312]

827-95-2    107-30-2   
3-Nitrobenzoesaeure-methoxymethylester 

[1]Thomas,H.Guenter;Kessel,Stephan[ChemischeBerichte,1985,vol.118,#7,p.2777-2788]

[1]Brady,Kieran;Hegarty,AnthonyF.[JournaloftheChemicalSociety.PerkintransactionsII,1980,p.121-126]

[1]O'Ferrall,RoryA.More;Larkin,Finbar;Walsh,Peter[JournaloftheChemicalSociety.PerkintransactionsII,1982,p.1573-1580]

Literature

Title: Influence of alkaline earth metals on molecular structure of 3-nitrobenzoic acid in comparison with alkali metals effect.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20111101

Title: 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: Journal of the American Chemical Society 20110817

Title: CdSe quantum dots capped PAMAM dendrimer nanocomposites for sensing nitroaromatic compounds.

Journal: Talanta 20110215

Title: Mitochondrial-dependent apoptosis in Huntington's disease human cybrids.

Journal: Experimental neurology 20100401

Title: Effect of long-term exposure, biogenic substrate presence, and electron acceptor conditions on the biodegradation of multiple substituted benzoates and phenolates.

Journal: Water research 20050901

Title: Biomass characteristics in three sequencing batch reactors treating a wastewater containing synthetic organic chemicals.

Journal: Water research 20050201

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SDS
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