Lot numbers can be found on the outside label of a product:
(S)-2-Hydroxy-4-phenylbutyric acid
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CAS No. 115016-95-0
- Cat. No. CS-W021166
- Purity≥97%
- MDL No.MFCD06656492
*For research and further manufacturing use only, not for direct human use.
Structure of 115016-95-0
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General Information
- CAS No. 115016-95-0
- Cat. No. CS-W021166
- Purity ≥97%
- MDL No. MFCD06656492
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₁₂O₃
- Molecular Weight 180.20
- Synonym(s) Benzenebutanoic acid, a-hydroxy-, (aS)-
- SMILES O[C@H](C(=O)O)CCC1=CC=CC=C1
Description
(S)-2-Hydroxy-4-phenylbutyric acid features a chiral α-hydroxy carboxylic acid scaffold with a pendant phenyl group at the C4 position. This configuration enables selective incorporation into bioactive molecules, particularly in synthetic routes targeting pharmaceutical intermediates and metabolite analogs. The molecule exhibits enhanced solubility and stability under standard bench conditions, facilitating handling in aqueous and organic media.
Synthesis
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Route1
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In-stock
710-11-2 - ~%
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In-stock
115016-95-0
References
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Bioscience, Biotechnology, and Biochemistry, , vol. 56, # 12 p. 2066 - 2067
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Route2
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In-stock
125639-64-7 - ~90%
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In-stock
115016-95-0
References
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Glueck, Silvia M.; Larissegger-Schnell, Barbara; Csar, Katrin; Kroutil, Wolfgang; Faber, Kurt Chemical Communications, 2005 , # 14 p. 1904 - 1905
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Route3
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146912-63-2 - ~92%
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In-stock
115016-95-0
References
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Lin, Wen-Qing; He, Ze; Jing, Yi; Cui, Xin; Liu, Hui; Mi, Ai-Qiao Tetrahedron Asymmetry, 2001 , vol. 12, # 11 p. 1583 - 1587
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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 57.53
- LogP 1.0647
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 4
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Key Words
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