Lot numbers can be found on the outside label of a product:
4-(5-Methyl-1,3,4-oxadiazol-2-yl)phenol
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CAS No. 25877-46-7
- Cat. No. CS-0084215
- Purity≥98%
- MDL No.MFCD04126174
*For research and further manufacturing use only, not for direct human use.
Structure of 25877-46-7
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General Information
- CAS No. 25877-46-7
- Cat. No. CS-0084215
- Purity ≥98%
- MDL No. MFCD04126174
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₈N₂O₂
- Molecular Weight 176.17
- Synonym(s) None
- SMILES OC1=CC=C(C2=NN=C(C)O2)C=C1
Description
4-(5-Methyl-1,3,4-oxadiazol-2-yl)phenol features a rigid, electron-deficient oxadiazole ring fused to a phenolic moiety, enabling strong hydrogen-bonding interactions and enhanced metabolic stability. This scaffold integrates seamlessly into bioactive molecules, serving as a key pharmacophore in kinase inhibitors and targeted therapeutics. The methylated oxadiazole enhances lipophilicity and membrane permeability while maintaining bench-stable handling under standard conditions.
Application
4-(5-Methyl-1,3,4-oxadiazol-2-yl)phenol serves as a versatile building block for bioactive heterocycles, enabling efficient construction of pharmaceutical scaffolds through its reactive oxadiazole ring and phenolic functionality. The molecule exhibits excellent bench stability, facilitates straightforward purification, and tolerates a range of functional groups, making it well-suited for medicinal chemistry campaigns and modular synthesis workflows.
Synthesis
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Route1
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In-stock
25877-54-7 - ~56%
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In-stock
25877-46-7
References
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Sadek, Bassem; Fahelelbom, Khairi Mustafa Salem Molecules, 2011 , vol. 16, # 6 p. 4339 - 4347
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Route2
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78-39-7 - ~98%
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In-stock
25877-46-7
References
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Janssen Pharmaceutica, N.V. Patent: US4218458 A1, 1980 ;
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Route3
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121-98-2 - ~%
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In-stock
25877-46-7
References
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Sadek, Bassem; Fahelelbom, Khairi Mustafa Salem Molecules, 2011 , vol. 16, # 6 p. 4339 - 4347
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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
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Precautionary Statements : P264-P270-P330-P501
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Quality Control
Computational Chemistry Data
- TPSA 59.15
- LogP 1.75062
- H_Acceptors 4
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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