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470482-41-8,MFCD08460520
Catalog No.:AA00DF2I

470482-41-8 | (2S,4S)-1-(tert-Butoxycarbonyl)-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$93.00   $65.00
- +
250mg
95%
in stock  
$140.00   $98.00
- +
500mg
95%
in stock  
$213.00   $149.00
- +
1g
95%
in stock  
$363.00   $254.00
- +
5g
95%
in stock  
$1,377.00   $964.00
- +
10g
95%
in stock  
$2,499.00   $1,750.00
- +
25g
95%
in stock  
$5,028.00   $3,520.00
- +
50g
95%
in stock  
$8,547.00   $5,983.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DF2I
Chemical Name:
(2S,4S)-1-(tert-Butoxycarbonyl)-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid
CAS Number:
470482-41-8
Molecular Formula:
C11H16F3NO4
Molecular Weight:
283.2442
MDL Number:
MFCD08460520
SMILES:
OC(=O)[C@@H]1C[C@@H](CN1C(=O)OC(C)(C)C)C(F)(F)F
Properties
Computed Properties
 
Complexity:
375  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.2  

Downstream Synthesis Route

[1]DelValle,JuanR.;Goodman,Murray[AngewandteChemie-InternationalEdition,2002,vol.41,#9,p.1600-1602]

[2]CurrentPatentAssignee:ASTRAZENECAPLC-WO2018/160889,2018,A1Locationinpatent:Page/Pagecolumn645;646;648

[3]CurrentPatentAssignee:ASTRAZENECAPLC-WO2022/66774,2022,A1Locationinpatent:Page/Pagecolumn239;329-328

[1]Jurica,ElizabethA.;Wu,Ximao;Williams,KristinN.;Hernandez,AndresS.;Nirschl,DavidS.;Rampulla,RichardA.;Mathur,Arvind;Zhou,Min;Cao,Gary;Xie,Chunshan;Jacob,Biji;Cai,Hong;Wang,Tao;Murphy,BrianJ.;Liu,Heng;Xu,Carrie;Kunselman,LoriK.;Hicks,MichaelB.;Sun,Qin;Schnur,DoraM.;Sitkoff,DoreeF.;Dierks,ElizabethA.;Apedo,Atsu;Moore,DouglasB.;Foster,KimberlyA.;Cvijic,MaryEllen;Panemangalore,Reshma;Flynn,NeilA.;Maxwell,BradD.;Hong,Yang;Tian,Yuan;Wilkes,JasonJ.;Zinker,BradleyA.;Whaley,JeanM.;Barrish,JoelC.;Robl,JeffreyA.;Ewing,WilliamR.;Ellsworth,BruceA.[JournalofMedicinalChemistry,2017,vol.60,#4,p.1417-1431]

[2]CurrentPatentAssignee:RIBONTHERAPEUTICSINC-US2019/330194,2019,A1Locationinpatent:Paragraph1340

89466-16-0    470482-41-8   
(2S,4S)-tert-butyl2-((6-bromo-3-methylpyridin-2-yl)carbamoyl)-4-(trifluoromethyl)pyrrolidine-1-carboxylate 

[1]Patent:WO2018/160889,2018,A1.Locationinpatent:Page/Pagecolumn645;646;649

Literature
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SDS
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Tags:470482-41-8 Molecular Formula|470482-41-8 MDL|470482-41-8 SMILES|470482-41-8 (2S,4S)-1-(tert-Butoxycarbonyl)-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid