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61485-46-9,MFCD00137889
Catalog No.:AA003KEF

61485-46-9 | 4,5-Bis(methylthio)-1,3-dithiol-2-one

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Purity
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Price(USD)
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200mg
>98.0%(GC)
in stock  
$120.00   $84.00
- +
1g
>98.0%(GC)
in stock  
$179.00   $125.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003KEF
Chemical Name:
4,5-Bis(methylthio)-1,3-dithiol-2-one
CAS Number:
61485-46-9
Molecular Formula:
C5H6OS4
Molecular Weight:
210.3605
MDL Number:
MFCD00137889
SMILES:
CSc1sc(=O)sc1SC
Properties
Properties
 
Storage:
Room Temperature;Light sensitive;Inert atmosphere;  

Computed Properties
 
Complexity:
168  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
2  
XLogP3:
2.8  

Downstream Synthesis Route

[1]ActachemicaScandinavica.SeriesB:Organicchemistryandbiochemistry,1980,vol.34,p.591-596

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:61485-46-9 Molecular Formula|61485-46-9 MDL|61485-46-9 SMILES|61485-46-9 4,5-Bis(methylthio)-1,3-dithiol-2-one