Home Other Building Blocks 3363-97-1
3363-97-1,MFCD00039561
Catalog No.:AA003DQM

3363-97-1 | 1,4-Bisbenzil

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250mg
98%
in stock  
$19.00   $14.00
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1g
95%
in stock  
$62.00   $44.00
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5g
98%
in stock  
$122.00   $86.00
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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:
AA003DQM
Chemical Name:
1,4-Bisbenzil
CAS Number:
3363-97-1
Molecular Formula:
C22H14O4
Molecular Weight:
342.3442
MDL Number:
MFCD00039561
SMILES:
O=C(C(=O)c1ccccc1)c1ccc(cc1)C(=O)C(=O)c1ccccc1
NSC Number:
379518
Properties
Properties
 
BP:
549°C at 760 mmHg  
Form:
Solid  
MP:
125°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
495  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
6  
XLogP3:
4.4  

Downstream Synthesis Route

[1]Schmittetal.[BulletindelaSocieteChimiquedeFrance,1956,p.636,641]

[1]Filimonov,V.D.;Yusubov,M.S.;Ogorodnikov,V.D.[JournalofOrganicChemistryUSSR(EnglishTranslation),1989,vol.25,#4.2,p.753-756][ZhurnalOrganicheskoiKhimii,1989,vol.25,#4,p.838-843]

[1]Savchenko,T.I.;Zubarev,V.E.;Yatsimirskii,A.K.[JournalofOrganicChemistryUSSR(EnglishTranslation),1989,vol.25,#3.1,p.495-500][ZhurnalOrganicheskoiKhimii,1989,vol.25,#3,p.552-558]

3363-97-1   
C22H14O4(1-) 

[1]Savchenko,T.I.;Zubarev,V.E.;Yatsimirskii,A.K.[JournalofOrganicChemistryUSSR(EnglishTranslation),1989,vol.25,#3.1,p.495-500][ZhurnalOrganicheskoiKhimii,1989,vol.25,#3,p.552-558]

[1]Savchenko,T.I.;Zubarev,V.E.;Yatsimirskii,A.K.[JournalofOrganicChemistryUSSR(EnglishTranslation),1989,vol.25,#3.1,p.495-500][ZhurnalOrganicheskoiKhimii,1989,vol.25,#3,p.552-558]

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: Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1.

Journal: Journal of medicinal chemistry 20071115

Title: Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases.

Journal: Journal of medicinal chemistry 20050421

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SDS
Tags:3363-97-1 Molecular Formula|3363-97-1 MDL|3363-97-1 SMILES|3363-97-1 1,4-Bisbenzil |Organic_Building_Blocks