Lot numbers can be found on the outside label of a product:
Lunularin
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CAS No. 37116-80-6
- Cat. No. CS-0086842
- Purity≥97%
- MDL No.MFCD24713452
*For research and further manufacturing use only, not for direct human use.
Structure of 37116-80-6
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General Information
- CAS No. 37116-80-6
- Cat. No. CS-0086842
- Purity ≥97%
- MDL No. MFCD24713452
- Storage 4°C, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₄H₁₄O₂
- Molecular Weight 214.26
- Synonym(s) None
- SMILES OC1=CC=C(CCC2=CC=CC(O)=C2)C=C1
Description
3-(4-Hydroxyphenethyl)phenol features a biphenyl core linked by an ethylene tether, bearing a phenolic hydroxyl at each terminus. This dual-hydroxyl architecture supports hydrogen bonding and enhances solubility in polar solvents. The molecule exhibits bench-stable behavior under standard conditions and integrates readily into synthetic routes requiring electron-rich aromatic scaffolds.
Application
3-(4-Hydroxyphenethyl)phenol serves as a versatile building block in the synthesis of bioactive scaffolds, leveraging its dual phenolic functionality for coupling reactions and derivatization. The molecule exhibits good bench stability and facilitates efficient functional group manipulation, enabling straightforward access to complex polyfunctionalized aromatics. Its structure supports applications in medicinal chemistry and materials science through predictable reactivity in etherification, oxidation, and transition-metal-catalyzed transformations.
Synthesis
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Route1
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52528-97-9 - ~61%
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In-stock
37116-80-6
References
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Sawada, Hiromi; Okazaki, Miki; Morita, Daichi; Kuroda, Teruo; Matsuno, Kenji; Hashimoto, Yuichi; Miyachi, Hiroyuki Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 24 p. 7444 - 7447
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Route2
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39032-14-9
- ~%
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In-stock
37116-80-6
References
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Huneck,S. Tetrahedron, 1976 , vol. 32, p. 109 - 113
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Route3
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In-stock
591-31-1 - ~%
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In-stock
37116-80-6
References
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Huneck,S. Tetrahedron, 1976 , vol. 32, p. 109 - 113
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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 40.46
- LogP 2.883
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 3
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