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2707-93-9,MFCD14608275
Catalog No.:AA01BE3H

2707-93-9 | 2-Methyl-2-(trifluoroacetamido)propanoic acid

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1g
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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:
AA01BE3H
Chemical Name:
2-Methyl-2-(trifluoroacetamido)propanoic acid
CAS Number:
2707-93-9
Molecular Formula:
C6H8F3NO3
Molecular Weight:
199.1278
MDL Number:
MFCD14608275
SMILES:
O=C(C(F)(F)F)NC(C(=O)O)(C)C
NSC Number:
192721
Properties
Computed Properties
 
Complexity:
234  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Leplawy,M.T.etal.[Tetrahedron,1960,vol.11,p.39-51]

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2005/111029,2005,A1Locationinpatent:Page/Pagecolumn187

[2]Nordlander,EricJ.;Payne,MarkJ.;Njoroge,GeorgeF.;Balk,MichaelA.;LaikosGeorgeD.;Vishwanath,VasanthM.[JournalofOrganicChemistry,1984,vol.49,#22,p.4107-4111]

[3]Neidlein;Strein;Pressmar;Kramer;Michel[ArchivderPharmazie,1992,vol.325,#11,p.727-732]

[4]Locationinpatent:experimentalpartDobrydnev,AlexeyV.;Volovnenko,TatyanaA.;Volovenko,YulianM.;Palamarchuk,GennadyV.;Shishkin,OlegV.[MonatsheftefurChemie,2012,vol.143,#5,p.779-789]

[5]Dobrydnev,AlexeyV.;Volovenko,YulianM.;Turov,AlexandrV.;Medviediev,VolodymyrV.;Shishkin,OlegV.;Volovnenko,TatyanaA.[MonatsheftefurChemie,2015,vol.146,#6,p.931-939]

[1]Leibfritz,Dieter;Haupt,Erhard;Dubischar,Norbert;Lachmann,Heinrich;Oekonomopulos,Raymond;Jung,Guenther[Tetrahedron,1982,vol.38,#14,p.2165-2182]

[2]Nathanael,JosesG.;Wille,Uta[JournalofOrganicChemistry,2019,vol.84,#6,p.3405-3418]

[3]Locationinpatent:schemeortableDobrydnev,AlexeyV.;Volovnenko,TatyanaA.;Volovenko,YulianM.;Palamarchuk,GennadyV.;Shishkin,OlegV.[MonatsheftefurChemie,2012,vol.143,#5,p.779-789]

[4]Dobrydnev,AlexeyV.;Volovenko,YulianM.;Turov,AlexandrV.;Medviediev,VolodymyrV.;Shishkin,OlegV.;Volovnenko,TatyanaA.[MonatsheftefurChemie,2015,vol.146,#6,p.931-939]

[1]Tanaka,Masakazu;Oba,Makoto;Imawaka,Naoto;Tanaka,Yoshitsugu;Kurihara,Masaaki;Suemune,Hiroshi[HelveticaChimicaActa,2001,vol.84,#1,p.32-46]

2707-93-9   
2-{2-(S)-2-(2-Amino-2-methyl-propionylamino)-2-ethyl-hexanoylamino-2-methyl-propionylamino}-2-methyl-propionicacidethylester 
 
ethyl2-{{2-{{(2S)-2-ethyl-2-{{2-methyl-2-{{2-methyl-1-oxo-2-(trifluoroacetyl)aminopropyl}amino}-1-oxopropyl}amino}-1-oxohexyl}amino}-2-methyl-1-oxopropyl}amino}-2-methylpropanoate 

[1]Tanaka,Masakazu;Oba,Makoto;Imawaka,Naoto;Tanaka,Yoshitsugu;Kurihara,Masaaki;Suemune,Hiroshi[HelveticaChimicaActa,2001,vol.84,#1,p.32-46]

Literature
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Tags:2707-93-9 Molecular Formula|2707-93-9 MDL|2707-93-9 SMILES|2707-93-9 2-Methyl-2-(trifluoroacetamido)propanoic acid