Lot numbers can be found on the outside label of a product:
2-(tert-Butyl)-4-ethylphenol
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CAS No. 96-70-8
- Cat. No. CS-W017309
- Purity≥97%
- MDL No.MFCD00069413
*For research and further manufacturing use only, not for direct human use.
Structure of 96-70-8
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General Information
- CAS No. 96-70-8
- Cat. No. CS-W017309
- Purity ≥97%
- MDL No. MFCD00069413
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₂H₁₈O
- Molecular Weight None
- Synonym(s) 2-tert-Butyl-4-ethylphenol
- SMILES CCC1=CC(=C(O)C=C1)C(C)(C)C
Description
This sterically hindered phenol features a tert-butyl group that enhances stability and solubility in organic media. The para-ethyl substituent imparts favorable electronic properties, making it effective as a heat and oxidative stabilizer in polymer formulations and lubricants.
Application
2-(tert-Butyl)-4-ethylphenol serves as a valuable phenolic building block in the synthesis of functionalized aromatic compounds. Its robust tert-butyl and ethyl substituents confer enhanced stability and solubility, while the phenolic hydroxyl group enables straightforward derivatization via esterification, etherification, or metal-catalyzed coupling reactions. This compound facilitates the construction of complex scaffolds in agrochemical and specialty material applications.
Synthesis
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Route1
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In-stock
123-07-9 -
115-11-7 - ~%
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4130-42-1
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In-stock
96-70-8
References
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Industrial and Engineering Chemistry, , vol. 35, p. 655,656 Journal of the American Chemical Society, , vol. 67, p. 303,305
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Route2
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In-stock
123-07-9
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95-48-7
- ~%
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In-stock
96-70-8
References
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US4950810 A1, ;
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Route3
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4130-42-1
- ~78%
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In-stock
123-07-9
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In-stock
96-70-8
References
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Journal of Organic Chemistry USSR (English Translation), , vol. 20, p. 2375 - 2378 Zhurnal Organicheskoi Khimii, , vol. 20, # 12 p. 2608 - 2611
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS05
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Signal Word : Danger
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UN#: 1760
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Class : 8
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Packing Group : Ⅲ
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Hazard Statements : H314
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Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 20.23
- LogP 3.2521
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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