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217316-44-4,MFCD04969005
Catalog No.:AA00BERC

217316-44-4 | (5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$489.00   $343.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BERC
Chemical Name:
(5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one
CAS Number:
217316-44-4
Molecular Formula:
C10H5ClFNOS2
Molecular Weight:
273.7342
MDL Number:
MFCD04969005
SMILES:
SC1=NC(=O)/C(=C\c2c(F)cccc2Cl)/S1
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
361  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.5  

Downstream Synthesis Route

[1]Akunuri,Ravikumar;Unnissa,Tanveer;Kaul,Grace;Akhir,Abdul;Saxena,Deepanshi;Wajidali,Mohmadd;Veerareddy,Vaishnavi;Yaddanapudi,VenkataMadhavi;Chopra,Sidharth;Nanduri,Srinivas[Chemistryandbiodiversity,2022,vol.19,#7]

[2]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2013/15456,2013,A1Locationinpatent:Page/Pagecolumn38

Literature
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Additional Info:
SDS
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Tags:217316-44-4 Molecular Formula|217316-44-4 MDL|217316-44-4 SMILES|217316-44-4 (5E)-5-(2-Chloro-6-fluorobenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one