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7605-28-9,MFCD00007550
Catalog No.:AA003TNG

7605-28-9 | Benzenesulfonylacetonitrile

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1g
98%
in stock  
$11.00   $8.00
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5g
98%
in stock  
$18.00   $13.00
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25g
98%
in stock  
$55.00   $39.00
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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:
AA003TNG
Chemical Name:
Benzenesulfonylacetonitrile
CAS Number:
7605-28-9
Molecular Formula:
C8H7NO2S
Molecular Weight:
181.2117
MDL Number:
MFCD00007550
SMILES:
N#CCS(=O)(=O)c1ccccc1
NSC Number:
51007
Properties
Properties
 
BP:
398.5 °C at 760 mmHg  
Form:
Solid  
MP:
112-114 °C(lit.)  
Refractive Index:
1.5650 (estimate)  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
274  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
0.9  

Downstream Synthesis Route

[1]Locationinpatent:schemeortableRahimizadeh,Mohammad;Rajabzadeh,Ghadir;Khatami,Seyed-Mola;Eshghi,Hossein;Shiri,Ali[JournalofMolecularCatalysisA:Chemical,2010,vol.323,#1-2,p.59-64]

[2]Chakravarthy,RajanDeepan;Ramkumar,Venkatachalam;Chand,DillipKumar[GreenChemistry,2014,vol.16,#4,p.2190-2196]

[3]Locationinpatent:experimentalpartLakouraj,MoslemMansour;Abdi,Hamid;Hasantabar,Vahid[JournalofSulfurChemistry,2011,vol.32,#5,p.435-441]

[4]Jereb,Marjan[GreenChemistry,2012,vol.14,#11,p.3047-3052,6]

[5]Dijkstra;Backer[RecueildesTravauxChimiquesdesPays-Bas,1954,vol.73,p.569,572]

[6]Gonzalez,PedroB.;Lopez,Rosa;Palomo,Claudio[JournalofOrganicChemistry,2010,vol.75,#11,p.3920-3922]

[7]Götz,KathrinH.;Hacker,StephanM.;Mayer,Daniel;Dürig,Jan-Niklas;Stenger,Steffen;Marx,Andreas[ACSChemicalBiology,2017,vol.12,#10,p.2682-2689]

[1]CatalysisLetters,2020,vol.150,p.2331-2351

[2]OrganicLetters,2013,vol.15,p.1386-1389

[3]JournaloftheIndianChemicalSociety,1955,vol.32,p.493,494

[4]ChemischeBerichte,1973,vol.106,p.2758-2766

[5]SyntheticCommunications,2000,vol.30,p.1879-1885

[6]ResearchonChemicalIntermediates,2018,vol.44,p.7219-7230

[7]JournaloftheIranianChemicalSociety,2019,vol.16,p.493-500

[1]CatalysisLetters,2020,vol.150,p.2331-2351

[2]JournalfurpraktischeChemie(Leipzig1954),1908,vol.<2>78,p.129

[3]ChemischeBerichte,1973,vol.106,p.2758-2766

[4]ResearchonChemicalIntermediates,2018,vol.44,p.7219-7230

[5]JournaloftheIranianChemicalSociety,2019,vol.16,p.493-500

[1]CatalysisLetters,2020,vol.150,p.2331-2351

[2]JournaloftheIndianChemicalSociety,1955,vol.32,p.493,494

Literature

Title: Switchable C- and N-bound isomers of transition-metal cyanocarbanions: synthesis and interconversions of cyclopentadienyl ruthenium complexes of phenylsulfonylacetonitrile anions.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20080101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Development of versatile cis- and trans-dicarbon-substituted chiral cyclopropane units: synthesis of (1S,2R)- and (1R,2R)-2-aminomethyl-1-(1H-imidazol-4-yl)cyclopropanes and their enantiomers as conformationally restricted analogues of histamine.

Journal: The Journal of organic chemistry 20020308

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