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1598-89-6,MFCD00039228
Catalog No.:AA001RCE

1598-89-6 | 3,3'-Bis(trifluoromethyl)benzhydrol

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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001RCE
Chemical Name:
3,3'-Bis(trifluoromethyl)benzhydrol
CAS Number:
1598-89-6
Molecular Formula:
C15H10F6O
Molecular Weight:
320.2297
MDL Number:
MFCD00039228
SMILES:
OC(c1cccc(c1)C(F)(F)F)c1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
330  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
4.5  

Downstream Synthesis Route

[1]CurrentPatentAssignee:INTESASANPAOLO-WO2020/225700,2020,A1Locationinpatent:Page/Pagecolumn61

[2]CurrentPatentAssignee:AMGENINC-US2008/4289,2008,A1Locationinpatent:Page/Pagecolumn32

[3]Lichtenberger,J.;Weiss,F.[BulletindelaSocieteChimiquedeFrance,1962,p.587-593]

[4]Lundgren,RylanJ.;Rankin,MatthewA.;McDonald,Robert;Schatte,Gabriele;Stradiotto,Mark[AngewandteChemie-InternationalEdition,2007,vol.46,#25,p.4732-4735]

[1]Mills,NancyS.;Tirla,Cornelia;Benish,MicheleA.;Rakowitz,AmberJ.;Bebell,LisaM.;Hurd,CarolineM.M.;Bria,AnnaL.M.[JournalofOrganicChemistry,2005,vol.70,#26,p.10709-10716]

[2]Wang,Chunhai;Huang,Xiaoling;Liu,Xueting;Gao,Suqian;Zhao,Bin;Yang,Shangdong[ChineseChemicalLetters,2020,vol.31,#3,p.677-680]

Literature
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SDS
Tags:1598-89-6 Molecular Formula|1598-89-6 MDL|1598-89-6 SMILES|1598-89-6 3,3'-Bis(trifluoromethyl)benzhydrol