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Home Fluorides 958457-42-6
958457-42-6,MFCD14581941
Catalog No.:AA01C5LZ

958457-42-6 | (4-[3-(Trifluoromethyl)phenoxy]phenyl)boranediol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$169.00   $118.00
- +
250mg
95%
in stock  
$288.00   $202.00
- +
500mg
95%
in stock  
$569.00   $398.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA01C5LZ
Chemical Name:
(4-[3-(Trifluoromethyl)phenoxy]phenyl)boranediol
CAS Number:
958457-42-6
Molecular Formula:
C13H10BF3O3
Molecular Weight:
282.0229
MDL Number:
MFCD14581941
SMILES:
OB(c1ccc(cc1)Oc1cccc(c1)C(F)(F)F)O
Properties
Computed Properties
 
Complexity:
304  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  

Downstream Synthesis Route

[1]Locationinpatent:schemeortableBueno,JoséM.;Manzano,Pilar;García,MaríaC.;Chicharro,Jesús;Puente,Margarita;Lorenzo,Milagros;García,Adolfo;Ferrer,Santiago;Gómez,RubénM.;Fraile,MaríaT.;Lavandera,JoséL.;Fiandor,JoséM.;Vidal,Jaume;Herreros,Esperanza;Gargallo-Viola,Domingo[BioorganicandMedicinalChemistryLetters,2011,vol.21,#18,p.5214-5218]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-EP1862459,2007,A1Locationinpatent:Page/Pagecolumn21

[1]Locationinpatent:schemeortableBueno,JoséM.;Manzano,Pilar;García,MaríaC.;Chicharro,Jesús;Puente,Margarita;Lorenzo,Milagros;García,Adolfo;Ferrer,Santiago;Gómez,RubénM.;Fraile,MaríaT.;Lavandera,JoséL.;Fiandor,JoséM.;Vidal,Jaume;Herreros,Esperanza;Gargallo-Viola,Domingo[BioorganicandMedicinalChemistryLetters,2011,vol.21,#18,p.5214-5218]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-EP1862459,2007,A1Locationinpatent:Page/Pagecolumn24

[1]Bueno,JoséM.;Manzano,Pilar;García,MaríaC.;Chicharro,Jesús;Puente,Margarita;Lorenzo,Milagros;García,Adolfo;Ferrer,Santiago;Gómez,RubénM.;Fraile,MaríaT.;Lavandera,JoséL.;Fiandor,JoséM.;Vidal,Jaume;Herreros,Esperanza;Gargallo-Viola,Domingo[BioorganicandMedicinalChemistryLetters,2011,vol.21,#18,p.5214-5218]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-EP1862459,2007,A1Locationinpatent:Page/Pagecolumn28

958457-42-6   
3-chloro-2-(hydroxymethyl)-6-methyl-5-(4-3(trifluoromethy)phenyloxy}phenyl)-pyridin-4(1H)-one 

[1]Bueno,JoséM.;Manzano,Pilar;García,MaríaC.;Chicharro,Jesús;Puente,Margarita;Lorenzo,Milagros;García,Adolfo;Ferrer,Santiago;Gómez,RubénM.;Fraile,MaríaT.;Lavandera,JoséL.;Fiandor,JoséM.;Vidal,Jaume;Herreros,Esperanza;Gargallo-Viola,Domingo[BioorganicandMedicinalChemistryLetters,2011,vol.21,#18,p.5214-5218]

958457-42-6   
2-hydroxymethyl-6-methyl-3-4-(3-trifluoromethyl-phenoxy)-phenyl-1H-pyridin-4-one 

[1]Bueno,JoséM.;Manzano,Pilar;García,MaríaC.;Chicharro,Jesús;Puente,Margarita;Lorenzo,Milagros;García,Adolfo;Ferrer,Santiago;Gómez,RubénM.;Fraile,MaríaT.;Lavandera,JoséL.;Fiandor,JoséM.;Vidal,Jaume;Herreros,Esperanza;Gargallo-Viola,Domingo[BioorganicandMedicinalChemistryLetters,2011,vol.21,#18,p.5214-5218]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-EP1862459,2007,A1

Literature
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SDS
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Tags:958457-42-6 Molecular Formula|958457-42-6 MDL|958457-42-6 SMILES|958457-42-6 (4-[3-(Trifluoromethyl)phenoxy]phenyl)boranediol