Home Iodos 2059-76-9
2059-76-9,MFCD00041091
Catalog No.:AA002AC9

2059-76-9 | 2-Iodophenyl isothiocyanate

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1g
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$32.00   $22.00
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5g
98%
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$65.00   $45.00
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25g
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$193.00   $135.00
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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:
AA002AC9
Chemical Name:
2-Iodophenyl isothiocyanate
CAS Number:
2059-76-9
Molecular Formula:
C7H4INS
Molecular Weight:
261.0828
MDL Number:
MFCD00041091
SMILES:
S=C=Nc1ccc(cc1)I
NSC Number:
129262
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;Light sensitive;Inert atmosphere;  

Computed Properties
 
Complexity:
146  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
4.2  

Downstream Synthesis Route

[1]Singh;Nagar;Chaudhari;Parmar[JournalofPharmaceuticalSciences,1973,vol.62,#3,p.504-507]

[1]Tiwari;SenGupta;Kumar[JournaloftheIndianChemicalSociety,1974,vol.51,#3,p.402-404]

2059-76-9    2043-61-0    171778-06-6   
2-3-cyclohexylmethyl-2-(4-iodo-phenylamino)-3,4-dihydro-quinazolin-4-yl-acetamide 

[1]Song,Aimin;Mařík,Jan;Lam,KitS.[TetrahedronLetters,2004,vol.45,#13,p.2727-2730]

[1]Locationinpatent:experimentalpartHoeglund,AdrienneB.;Bostic,HeidiE.;Howard,AngelaL.;Wanjala,IreneW.;Best,MichaelD.;Baker,DanielL.;Parrill,AbbyL.[JournalofMedicinalChemistry,2010,vol.53,#3,p.1056-1066]

[2]CurrentPatentAssignee:TENNESSEEBOARDOFREGENTS-US2012/100592,2012,A1

[1]Locationinpatent:experimentalpartPlech,Tomasz;Wujec,Monika;Siwek,Agata;Kosikowska,Urszula;Malm,Anna[EuropeanJournalofMedicinalChemistry,2011,vol.46,#1,p.241-248]

[2]Plech,Tomasz;Kapron,Barbara;Luszczki,JarogniewJ.;Wujec,Monika;Paneth,Agata;Siwek,Agata;Kolaczkowski,Marcin;Zolnierek,Maria;Nowak,Gabriel[Molecules,2014,vol.19,#8,p.11279-11299]

[3]Plech,Tomasz;Wujec,Monika;Kosikowska,Urszula;Malm,Anna;Rajtar,Barbara;Polz-Dacewicz,Malgorzata[EuropeanJournalofMedicinalChemistry,2013,vol.60,p.128-134]

Literature

Title: 4-iodophenyl isothiocyanate: a neuroprotective compound.

Journal: Restorative neurology and neuroscience 20120101

Title: Passive and active fragment ion mass defect labeling: distinct proteomics potential of iodine-based reagents.

Journal: Analytical chemistry 20090801

Title: Averagine-scaling analysis and fragment ion mass defect labeling in peptide mass spectrometry.

Journal: Analytical chemistry 20081001

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SDS
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