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115957-22-7,MFCD03001310
Catalog No.:AA000H53

115957-22-7 | 3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid

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250mg
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$265.00   $185.00
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1g
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$515.00   $360.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000H53
Chemical Name:
3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid
CAS Number:
115957-22-7
Molecular Formula:
C9H8F3NO3S
Molecular Weight:
267.2249
MDL Number:
MFCD03001310
SMILES:
OC(=O)CC(c1cccs1)NC(=O)C(F)(F)F
Properties
Computed Properties
 
Complexity:
308  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Zipfel,Pauline;Lalut,Julien;Sopková-DeOliveiraSantos,Jana;Rochais,Christophe;Dallemagne,Patrick[Synthesis,2021,vol.53,#20,p.3799-3814]

[2]Dallemagne,Patrick;Rault,Sylvain;Gordaliza,Marina;Robba,Max[Heterocycles,1987,vol.26,#12,p.3233-3237]

[3]Renault,Olivier;Guillon,Jean;Dallemagne,Patrick;Rault,Sylvain[TetrahedronLetters,2000,vol.41,#5,p.681-683]

[4]Leflemme,Nicolas;Dallemagne,Patrick;Rault,Sylvain[TetrahedronLetters,2001,vol.42,#51,p.8997-8999]

115957-22-7   
3-Thiophen-2-yl-3-(2,2,2-trifluoro-acetylamino)-propionylazide 

[1]Rault,Sylvain;Tembo,OlivierN.;Dallemagne,Patrick;Robba,Max[Heterocycles,1991,vol.32,#7,p.1301-1305]

[1]Dallemagne,Patrick;Rault,Sylvain;Gordaliza,Marina;Robba,Max[Heterocycles,1987,vol.26,#12,p.3233-3237]

[2]Renault,Olivier;Guillon,Jean;Dallemagne,Patrick;Rault,Sylvain[TetrahedronLetters,2000,vol.41,#5,p.681-683]

[3]Leflemme,Nicolas;Dallemagne,Patrick;Rault,Sylvain[TetrahedronLetters,2001,vol.42,#51,p.8997-8999]

[1]Renault,Olivier;Dallemagne,Patrick;Rault,Sylvain[OrganicPreparationsandProceduresInternational,1997,vol.29,#4,p.488-494]

[1]Zipfel,Pauline;Lalut,Julien;Sopková-DeOliveiraSantos,Jana;Rochais,Christophe;Dallemagne,Patrick[Synthesis,2021,vol.53,#20,p.3799-3814]

[2]Renault,Olivier;Dallemagne,Patrick;Rault,Sylvain[OrganicPreparationsandProceduresInternational,1997,vol.29,#4,p.488-494]

Literature
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SDS
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Tags:115957-22-7 Molecular Formula|115957-22-7 MDL|115957-22-7 SMILES|115957-22-7 3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid