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336818-78-1,MFCD06656435
Catalog No.:AA0037X2

336818-78-1 | (2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$16.00   $11.00
- +
250mg
95%
in stock  
$30.00   $21.00
- +
1g
98%
in stock  
$102.00   $71.00
- +
5g
98%
in stock  
$506.00   $355.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0037X2
Chemical Name:
(2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid
CAS Number:
336818-78-1
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD06656435
SMILES:
O=C(N1C[C@H](C[C@H]1C(=O)O)c1ccccc1)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
396  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.6  

Downstream Synthesis Route

[1]O'Connell,CelesteE.;Rowell,CherylA.;Ackermann,Karen;Garcia,AnaMaria;Lewis,MichaelD.;Kowalczyk,JamesJ.[ChemicalandPharmaceuticalBulletin,2000,vol.48,#5,p.740-742]

[1]O'Connell,CelesteE.;Rowell,CherylA.;Ackermann,Karen;Garcia,AnaMaria;Lewis,MichaelD.;Kowalczyk,JamesJ.[ChemicalandPharmaceuticalBulletin,2000,vol.48,#5,p.740-742]

[2]Kondo,Takashi;Sugimoto,Isamu;Nekado,Takahiro;Ochi,Kenya;Ohtani,Tazumi;Tajima,Yohei;Yamamoto,Susumu;Kawabata,Kazuhito;Nakai,Hisao;Toda,Masaaki[BioorganicandMedicinalChemistry,2007,vol.15,#7,p.2715-2735]

[1]CurrentPatentAssignee:CURIAINC;MERCK&COINC-US2008/4287,2008,A1Locationinpatent:Page/Pagecolumn91

(2S)-pyrrolidine-2-carbonitrilehydrochloride 
  336818-78-1    934470-67-4 

[1]Kondo,Takashi;Sugimoto,Isamu;Nekado,Takahiro;Ochi,Kenya;Ohtani,Tazumi;Tajima,Yohei;Yamamoto,Susumu;Kawabata,Kazuhito;Nakai,Hisao;Toda,Masaaki[BioorganicandMedicinalChemistry,2007,vol.15,#7,p.2715-2735]

[1]Kondo,Takashi;Sugimoto,Isamu;Nekado,Takahiro;Ochi,Kenya;Ohtani,Tazumi;Tajima,Yohei;Yamamoto,Susumu;Kawabata,Kazuhito;Nakai,Hisao;Toda,Masaaki[BioorganicandMedicinalChemistry,2007,vol.15,#7,p.2715-2735]

Literature
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SDS
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Tags:336818-78-1 Molecular Formula|336818-78-1 MDL|336818-78-1 SMILES|336818-78-1 (2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid