Home Fluorides 14091-16-8
14091-16-8,MFCD00070813
Catalog No.:AA007LE6

14091-16-8 | 4-(Trifluoromethyl)-dl-phenylalanine

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250mg
98%
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$41.00   $29.00
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1g
98%
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$96.00   $68.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
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  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA007LE6
Chemical Name:
4-(Trifluoromethyl)-dl-phenylalanine
CAS Number:
14091-16-8
Molecular Formula:
C10H10F3NO2
Molecular Weight:
233.1871
MDL Number:
MFCD00070813
SMILES:
NC(C(=O)O)Cc1ccc(cc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-0.6  

Downstream Synthesis Route

[1]Brunner;Kroiss;Schmidt;Schonenberger[EuropeanJournalofMedicinalChemistry,1986,vol.21,#4,p.333-338]

[1]Augelli-Szafran,CorinneE.;Horwell,DavidC.;Kneen,Clare;Ortwine,DanielF.;Pritchard,MartynC.;Purchase,TerriS.;Roth,BruceD.;Trivedi,BharatK.;Hill,David;Suman-Chauhan,Nirmala;Webdale,Louise[BioorganicandMedicinalChemistry,1996,vol.4,#10,p.1733-1745]

[1]AngewandteChemie-InternationalEdition,2014,vol.53,p.4652-4656    Angew.Chem.,2014,vol.126,p.4740-4744,5

Literature
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SDS
Tags:14091-16-8 Molecular Formula|14091-16-8 MDL|14091-16-8 SMILES|14091-16-8 4-(Trifluoromethyl)-dl-phenylalanine