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978-86-9,MFCD00002364
Catalog No.:AA00342W

978-86-9 | 4-Tritylphenol

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5g
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25g
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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:
AA00342W
Chemical Name:
4-Tritylphenol
CAS Number:
978-86-9
Molecular Formula:
C25H20O
Molecular Weight:
336.4257
MDL Number:
MFCD00002364
SMILES:
Oc1ccc(cc1)C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Properties
 
BP:
432.9°C (rough estimate)  
Form:
Solid  
MP:
283-286 °C(lit.)  
Refractive Index:
1.6380 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
358  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
6.6  

Downstream Synthesis Route
978-86-9   
tris(phenyl)(4-hydroxy-3-nitrophenyl)methane 

[1]Frischmann,PeterD.;Guieu,Samuel;Tabeshi,Raymond;MacLachlan,MarkJ.[JournaloftheAmericanChemicalSociety,2010,vol.132,#22,p.7668-7675]

[2]Zincke;Wugk[JustusLiebigsAnnalenderChemie,1908,vol.363,p.288]

[3]Zincke;Wugk[JustusLiebigsAnnalenderChemie,1908,vol.363,p.288]

[4]Frischmann,PeterD.;Sahli,BrianJ.;Guieu,Samuel;Patrick,BrianO.;MacLachlan,MarkJ.[Chemistry-AEuropeanJournal,2012,vol.18,#43,p.13712-13721]

[1]Ipatjew;Dolgow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1927,vol.59,p.1090]Ipatjew;Dolgow[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1927,vol.185,p.212][BulletindelaSocieteChimiquedeFrance,1927,vol.<4>41,p.1624]

[2]Ipatjew;Dolgow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1927,vol.59,p.1090]Ipatjew;Dolgow[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1927,vol.185,p.212][BulletindelaSocieteChimiquedeFrance,1927,vol.<4>41,p.1624]

[1]Ipatjew;Dolgow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1927,vol.59,p.1090]Ipatjew;Dolgow[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1927,vol.185,p.212][BulletindelaSocieteChimiquedeFrance,1927,vol.<4>41,p.1624]

[1]CurrentPatentAssignee:PFIZERINC-US6214877,2001,B1

[2]Zincke;Wugk[JustusLiebigsAnnalenderChemie,1908,vol.363,p.288]

[1]Ipatjew;Dolgow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1927,vol.59,p.1090]Ipatjew;Dolgow[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1927,vol.185,p.212][BulletindelaSocieteChimiquedeFrance,1927,vol.<4>41,p.1624]

Literature

Title: Discovery of novel SERCA inhibitors by virtual screening of a large compound library.

Journal: European journal of medicinal chemistry 20110501

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Tags:978-86-9 Molecular Formula|978-86-9 MDL|978-86-9 SMILES|978-86-9 4-Tritylphenol