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Home Other Building Blocks 7333-08-6
7333-08-6,MFCD19105338
Catalog No.:AA00ICB8

7333-08-6 | 1,2-Di-3-thienyl-1,2-ethanedione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$50.00   $35.00
- +
1g
95%
in stock  
$124.00   $87.00
- +
5g
95%
in stock  
$443.00   $310.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00ICB8
Chemical Name:
1,2-Di-3-thienyl-1,2-ethanedione
CAS Number:
7333-08-6
Molecular Formula:
C10H6O2S2
Molecular Weight:
222.2834
MDL Number:
MFCD19105338
SMILES:
O=C(C(=O)c1cscc1)c1cscc1
Properties
Computed Properties
 
Complexity:
227  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
XLogP3:
2.3  

Literature

Title: Comparison of benzil and trifluoromethyl ketone (TFK)-mediated carboxylesterase inhibition using classical and 3D-quantitative structure-activity relationship analysis.

Journal: Bioorganic & medicinal chemistry 20090101

Title: Inhibition of carboxylesterases by benzil (diphenylethane-1,2-dione) and heterocyclic analogues is dependent upon the aromaticity of the ring and the flexibility of the dione moiety.

Journal: Journal of medicinal chemistry 20050825

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SDS
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Tags:7333-08-6 Molecular Formula|7333-08-6 MDL|7333-08-6 SMILES|7333-08-6 1,2-Di-3-thienyl-1,2-ethanedione