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188472-71-1,MFCD08703530
Catalog No.:AA002GU4

188472-71-1 | 4-Chloro-1-ethynyl-2-fluorobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$44.00   $31.00
- +
1g
95%
in stock  
$95.00   $67.00
- +
5g
95%
in stock  
$285.00   $199.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002GU4
Chemical Name:
4-Chloro-1-ethynyl-2-fluorobenzene
CAS Number:
188472-71-1
Molecular Formula:
C8H4ClF
Molecular Weight:
154.5688
MDL Number:
MFCD08703530
SMILES:
C#Cc1ccc(cc1F)Cl
Properties
Computed Properties
 
Complexity:
158  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.9  

Downstream Synthesis Route
188472-71-1    1402636-76-3   
C19H24ClFN4O5S 

[1]McAllister,LauraA.;Montgomery,JustinI.;Abramite,JosephA.;Reilly,Usa;Brown,MatthewF.;Chen,JinshanM.;Barham,RoseA.;Che,Ye;Chung,SeungWon;Menard,CarolA.;Mitton-Fry,Mark;Mullins,LisaM.;Noe,MarkC.;O'Donnell,JohnP.;OliverIII,RobertM.;Penzien,JosephB.;Plummer,Mark;Price,LorenM.;Shanmugasundaram,Veerabahu;Tomaras,AndrewP.;Uccello,DanielP.[Bioorganicandmedicinalchemistryletters,2012,vol.22,#22,p.6832-6838,7]

[1]CurrentPatentAssignee:ICHNOSSCIENCESINC-WO2013/186692,2013,A1Locationinpatent:Page/Pagecolumn115

[2]CurrentPatentAssignee:GASHERBRUMBIO-WO2022/28572,2022,A1Locationinpatent:Page/Pagecolumn162-164

[1]CurrentPatentAssignee:ICHNOSSCIENCESINC-WO2013/186692,2013,A1

[2]CurrentPatentAssignee:GASHERBRUMBIO-WO2022/28572,2022,A1

188472-71-1    98-86-2   
8-chloro-2-phenylbenzoboxepine 

[1]Ouyang,Lu;Qi,Chaorong;He,Haitao;Peng,Youbin;Xiong,Wenfang;Ren,Yanwei;Jiang,Huanfeng[JournalofOrganicChemistry,2016,vol.81,#3,p.912-919]

188472-71-1    5586-88-9   
8-chloro-3-(4-chlorophenyl)-2-methylbenzoboxepine 

[1]Ouyang,Lu;Qi,Chaorong;He,Haitao;Peng,Youbin;Xiong,Wenfang;Ren,Yanwei;Jiang,Huanfeng[JournalofOrganicChemistry,2016,vol.81,#3,p.912-919]

Literature
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SDS
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Tags:188472-71-1 Molecular Formula|188472-71-1 MDL|188472-71-1 SMILES|188472-71-1 4-Chloro-1-ethynyl-2-fluorobenzene