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Home Fluorides 1017294-05-1
1017294-05-1,MFCD08436171
Catalog No.:AA00058P

1017294-05-1 | Methyl n-acetyl-3-(2,5-difluorophenyl)-d-alaninate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$144.00   $101.00
- +
1g
97%
in stock  
$170.00   $119.00
- +
5g
97%
in stock  
$408.00   $285.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00058P
Chemical Name:
Methyl n-acetyl-3-(2,5-difluorophenyl)-d-alaninate
CAS Number:
1017294-05-1
Molecular Formula:
C12H13F2NO3
Molecular Weight:
257.2333
MDL Number:
MFCD08436171
SMILES:
COC(=O)[C@@H](Cc1cc(F)ccc1F)NC(=O)C
Properties
Computed Properties
 
Complexity:
312  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
1.7  

Downstream Synthesis Route

[1]Etayo,Pablo;Nunez-Rico,JoseLuis;Fernandez-Perez,Hector;Vidal-Ferran,Anton[Chemistry-AEuropeanJournal,2011,vol.17,#50,p.13978-13982]

[1]Biosca,Maria;DeLaCruz-Sánchez,Pol;Diéguez,Montserrat;Pàmies,Oscar[JournalofOrganicChemistry,2020,vol.85,#7,p.4730-4739]

[2]Locationinpatent:experimentalpartEtayo,Pablo;Nunez-Rico,JoseL.;Vidal-Ferran,Anton[Organometallics,2011,vol.30,#24,p.6718-6725]

1017294-05-1   
C10H11F2NO2 

[1]Yu,Hannah;Richey,RachelN.;Stout,JamesR.;LaPack,MarkA.;Gu,Ruilin;Khau,VienV.;Frank,ScottA.;Ott,JoelP.;Miller,RichardD.;Carr,MichaelA.;Zhang,TonyY.[OrganicProcessResearchandDevelopment,2008,vol.12,#2,p.218-225]

1017294-05-1   
C24H23F2NO2 

[1]Yu,Hannah;Richey,RachelN.;Stout,JamesR.;LaPack,MarkA.;Gu,Ruilin;Khau,VienV.;Frank,ScottA.;Ott,JoelP.;Miller,RichardD.;Carr,MichaelA.;Zhang,TonyY.[OrganicProcessResearchandDevelopment,2008,vol.12,#2,p.218-225]

[1]Yu,Hannah;Richey,RachelN.;Stout,JamesR.;LaPack,MarkA.;Gu,Ruilin;Khau,VienV.;Frank,ScottA.;Ott,JoelP.;Miller,RichardD.;Carr,MichaelA.;Zhang,TonyY.[OrganicProcessResearchandDevelopment,2008,vol.12,#2,p.218-225]

Literature
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SDS
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Tags:1017294-05-1 Molecular Formula|1017294-05-1 MDL|1017294-05-1 SMILES|1017294-05-1 Methyl n-acetyl-3-(2,5-difluorophenyl)-d-alaninate