Lot numbers can be found on the outside label of a product:
(R)-2-((tert-Butoxycarbonyl)amino)-3-(2,4,5-trifluorophenyl)propanoic acid
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CAS No. 486460-09-7
- Cat. No. CS-0097838
- Purity≥97%
- MDL No.MFCD06659118
*For research and further manufacturing use only, not for direct human use.
Structure of 486460-09-7
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General Information
- CAS No. 486460-09-7
- Cat. No. CS-0097838
- Purity ≥97%
- MDL No. MFCD06659118
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₄H₁₆F₃NO₄
- Molecular Weight 319.28
- Synonym(s) boc-d-2,4,5-trifluorophenylalanine
- SMILES O=C([C@@H](CC1=CC(F)=C(C=C1F)F)NC(OC(C)(C)C)=O)O
Description
(R)-2-((tert-Butoxycarbonyl)amino)-3-(2,4,5-trifluorophenyl)propanoic acid is a chiral building block featuring a trifluorophenyl moiety and a protected amino group. This bench-stable, moisture-tolerant derivative enables direct incorporation into peptide synthesis workflows. The electron-deficient aryl ring enhances reactivity in coupling reactions, while the (R)-configuration ensures stereochemical fidelity in target molecule construction.
Application
(R)-2-((tert-Butoxycarbonyl)amino)-3-(2,4,5-trifluorophenyl)propanoic acid serves as a valuable chiral building block in medicinal chemistry, enabling the synthesis of peptide-like scaffolds and bioactive molecules. The tert-butyl carbamate (Boc) group provides excellent stability and orthogonal deprotection under mild acidic conditions, while the 2,4,5-trifluorophenyl moiety enhances metabolic stability and modulates electronic properties. This compound facilitates efficient coupling reactions and is well-suited for solid-phase and solution-phase synthesis workflows.
Synthesis
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Route1
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486460-08-6 - ~%
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In-stock
486460-09-7
References
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MERCK and CO., INC. Patent: WO2006/23750 A2, 2006 ; Location in patent: Page/Page column 43 ; WO 2006/023750 A2
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Route2
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In-stock
24424-99-5 - ~%
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In-stock
486460-09-7
References
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Kim, Dooseop; Wang, Liping; Beconi, Maria; Eiermann, George J.; Fisher, Michael H.; He, Huaibing; Hickey, Gerard J.; Kowalchick, Jennifer E.; Leiting, Barbara; Lyons, Kathryn; Marsilio, Frank; McCann, Margaret E.; Patel, Reshma A.; Petrov, Aleksandr; Scapin, Giovanna; Patel, Sangita B.; Roy, Ranabir Sinha; Wu, Joseph K.; Wyvratt, Matthew J.; Zhang, Bei B.; Zhu, Lan; Thornberry, Nancy A.; Weber, Ann E. Journal of Medicinal Chemistry, 2005 , vol. 48, # 1 p. 141 - 151
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Route3
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157911-56-3
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In-stock
486460-09-7
References
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Kim, Dooseop; Wang, Liping; Beconi, Maria; Eiermann, George J.; Fisher, Michael H.; He, Huaibing; Hickey, Gerard J.; Kowalchick, Jennifer E.; Leiting, Barbara; Lyons, Kathryn; Marsilio, Frank; McCann, Margaret E.; Patel, Reshma A.; Petrov, Aleksandr; Scapin, Giovanna; Patel, Sangita B.; Roy, Ranabir Sinha; Wu, Joseph K.; Wyvratt, Matthew J.; Zhang, Bei B.; Zhu, Lan; Thornberry, Nancy A.; Weber, Ann E. Journal of Medicinal Chemistry, 2005 , vol. 48, # 1 p. 141 - 151
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 75.63
- LogP 2.6243
- H_Acceptors 3
- H_Donors 2
- Rotatable_Bonds 4
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Key Words
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