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899806-25-8,MFCD09878160
Catalog No.:AA00IFUE

899806-25-8 | 2-Chloro-6-fluorophenyl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95+%
in stock  
$67.00   $47.00
- +
5g
95+%
in stock  
$117.00   $82.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IFUE
Chemical Name:
2-Chloro-6-fluorophenyl isothiocyanate
CAS Number:
899806-25-8
Molecular Formula:
C7H3ClFNS
Molecular Weight:
187.6218
MDL Number:
MFCD09878160
SMILES:
S=C=Nc1c(F)cccc1Cl
Properties
Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
4.1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:LIGANDPHARMACEUTICALSINC;BRISTOL-MYERSSQUIBBCO-WO2006/76595,2006,A1Locationinpatent:Page/Pagecolumn153

[1]CurrentPatentAssignee:FMCCORP-WO2012/31061,2012,A2Locationinpatent:Page/Pagecolumn54

[2]CurrentPatentAssignee:FMCCORP-WO2013/116251,2013,A2Locationinpatent:Page/Pagecolumn30

[3]CurrentPatentAssignee:GLENMARKPHARMACEUTICALSLTD-WO2013/153535,2013,A1Locationinpatent:Page/Pagecolumn54

[4]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2014/189753,2014,A1Locationinpatent:Page/Pagecolumn20

[5]Muthukaman,Nagarajan;Tambe,Macchindra;Deshmukh,Sanjay;Pisal,Dnyandeo;Tondlekar,Shital;Shaikh,Mahamadhanif;Sarode,Neelam;Kattige,VidyaG.;Pisat,Monali;Sawant,Pooja;Honnegowda,Srinivasa;Karande,Vikas;Kulkarni,Abhay;Behera,Dayanidhi;Jadhav,SatyawanB.;Sangana,RamchandraR.;Gudi,GirishS.;Khairatkar-Joshi,Neelima;Gharat,LaxmikantA.[BioorganicandMedicinalChemistryLetters,2017,vol.27,#23,p.5131-5138]

[6]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2014/130409,2014,A2Locationinpatent:Page/Pagecolumn37

899806-25-8    1250021-16-9   
α-acetyl-2-bromo-N-(2-chloro-6-fluorophenyl)-4-fluorobenzeneethanethioamide 

[1]CurrentPatentAssignee:FMCCORP-WO2012/31061,2012,A2Locationinpatent:Page/Pagecolumn54;55

[2]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2014/189753,2014,A1Locationinpatent:Page/Pagecolumn23

[1]Muthukaman,Nagarajan;Deshmukh,Sanjay;Tambe,Macchindra;Pisal,Dnyandeo;Tondlekar,Shital;Shaikh,Mahamadhanif;Sarode,Neelam;Kattige,VidyaG.;Sawant,Pooja;Pisat,Monali;Karande,Vikas;Honnegowda,Srinivasa;Kulkarni,Abhay;Behera,Dayanidhi;Jadhav,SatyawanB.;Sangana,RamchandraR.;Gudi,GirishS.;Khairatkar-Joshi,Neelima;Gharat,LaxmikantA.[BioorganicandMedicinalChemistryLetters,2018,vol.28,#7,p.1211-1218]

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SDS
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Tags:899806-25-8 Molecular Formula|899806-25-8 MDL|899806-25-8 SMILES|899806-25-8 2-Chloro-6-fluorophenyl isothiocyanate