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704-38-1,MFCD00052096
Catalog No.:AA003O67

704-38-1 | Bis(2-thienyl) ketone

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100mg
97%
in stock  
$6.00   $4.00
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250mg
97%
in stock  
$8.00   $6.00
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1g
97%
in stock  
$18.00   $13.00
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5g
97%
in stock  
$78.00   $55.00
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10g
97%
in stock  
$155.00   $109.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003O67
Chemical Name:
Bis(2-thienyl) ketone
CAS Number:
704-38-1
Molecular Formula:
C9H6OS2
Molecular Weight:
194.2733
MDL Number:
MFCD00052096
SMILES:
O=C(c1cccs1)c1cccs1
Properties
Properties
 
BP:
326.0°C  
Form:
Solid  
MP:
90-94 °C(lit.)  
Refractive Index:
1.5970 (estimate)  
Storage:
Light sensitive;Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
3.3  

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,DaltonTransactions,1995,p.4021-4028

[2]ChemischeBerichte,1885,vol.18,p.3013

[1]TetrahedronLetters,2013,vol.54,p.1738-1742

[2]BulletindelaSocieteChimiquedeFrance,1955,p.1583,1585

[3]JournaloftheAmericanChemicalSociety,1952,vol.74,p.1733,1735

[4]JustusLiebigsAnnalenderChemie,1932,vol.495,p.144,162

[5]ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1914,vol.46,p.1616    ChemischesZentralblatt,1915,vol.86,p.78

[1]JournaloftheAmericanChemicalSociety,1947,vol.69,p.3098

[2]JournaloftheChemicalSociety,1956,p.698,703

[1]ZhurnalObshcheiKhimii,1959,vol.29,p.3873,3878;engl.Ausg.S.3831,3836

[1]ActaChemicaScandinavica(1947),1952,vol.6,p.1020,1022

Literature

Title: Effects of hydrogen bond and solvent polarity on the C=O stretching of bis(2-thienyl)ketone in solution.

Journal: The Journal of chemical physics 20120328

Title: Investigation of excited state structural dynamics of bis(2-thienyl)ketone in the condensed phase using Raman, IR, and UV-visible spectroscopy aided by density functional theory calculation.

Journal: The journal of physical chemistry. B 20101223

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

Title: Nuclear magnetic resonance and optosensing properties of di-2-thienyl ketone p-nitrophenylhydrazone (DSKNPH) in non-aqueous media.

Journal: Talanta 20040310

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SDS
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