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27761-02-0,MFCD00022505
Catalog No.:AA002UM1

27761-02-0 | 2-Hydroxy-1,2-di(thiophen-2-yl)ethanone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$24.00   $17.00
- +
250mg
95%
in stock  
$43.00   $30.00
- +
500mg
95%
in stock  
$60.00   $42.00
- +
1g
95%
in stock  
$85.00   $60.00
- +
2g
95%
in stock  
$152.00   $107.00
- +
5g
95%
in stock  
$247.00   $173.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002UM1
Chemical Name:
2-Hydroxy-1,2-di(thiophen-2-yl)ethanone
CAS Number:
27761-02-0
Molecular Formula:
C10H8O2S2
Molecular Weight:
224.2993
MDL Number:
MFCD00022505
SMILES:
O=C(C(c1cccs1)O)c1cccs1
Properties
Properties
 
BP:
410.8°C at 760 mmHg  
Form:
Solid  
MP:
114-115 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
220  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartKang,Sunhae;Joo,Cheonik;Kim,SunMin;Han,Hogyu;Yang,JungWoon[TetrahedronLetters,2011,vol.52,#4,p.502-504]

[2]Teng,Jia-nan;Zhu,Rui;Li,Xinglong;Fu,Yao[ChemCatChem,2021,vol.13,#20,p.4355-4363]

[3]Zhan,Haiying;Liu,Wenjie;Fu,Minling;Cen,Jinghe;Lin,Jingxin;Cao,Hua[AppliedCatalysisA:General,2013,vol.468,p.184-189]

[1]Patent:CN104557768,2016,B.Locationinpatent:Paragraph0087-0090

Literature

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:27761-02-0 Molecular Formula|27761-02-0 MDL|27761-02-0 SMILES|27761-02-0 2-Hydroxy-1,2-di(thiophen-2-yl)ethanone
Catalog No.: AA002UM1
27761-02-0,MFCD00022505
27761-02-0 | 2-Hydroxy-1,2-di(thiophen-2-yl)ethanone
Pack Size： 100mg
Purity： 95%
in stock
$24.00 $17.00
Pack Size： 250mg
Purity： 95%
in stock
$43.00 $30.00
Pack Size： 500mg
Purity： 95%
in stock
$60.00 $42.00
Pack Size： 1g
Purity： 95%
in stock
$85.00 $60.00
Pack Size： 2g
Purity： 95%
in stock
$152.00 $107.00
Pack Size： 5g
Purity： 95%
in stock
$247.00 $173.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA002UM1
Chemical Name: 2-Hydroxy-1,2-di(thiophen-2-yl)ethanone
CAS Number: 27761-02-0
Molecular Formula: C10H8O2S2
Molecular Weight: 224.2993
MDL Number: MFCD00022505
SMILES: O=C(C(c1cccs1)O)c1cccs1
Properties
BP: 410.8°C at 760 mmHg  
Form: Solid  
MP: 114-115 °C  
Storage: Keep in dry area;Room Temperature;  
Complexity: 220  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Downstream Synthesis Route
27761-02-0    527-72-0 

[1]Locationinpatent:experimentalpartKang,Sunhae;Joo,Cheonik;Kim,SunMin;Han,Hogyu;Yang,JungWoon[TetrahedronLetters,2011,vol.52,#4,p.502-504]

[2]Teng,Jia-nan;Zhu,Rui;Li,Xinglong;Fu,Yao[ChemCatChem,2021,vol.13,#20,p.4355-4363]

[3]Zhan,Haiying;Liu,Wenjie;Fu,Minling;Cen,Jinghe;Lin,Jingxin;Cao,Hua[AppliedCatalysisA:General,2013,vol.468,p.184-189]

27761-02-0    137-07-5    34243-38-4 

[1]Patent:CN104557768,2016,B.Locationinpatent:Paragraph0087-0090

Literature fold

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 chemistry20050825

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