Lot numbers can be found on the outside label of a product:
2,6-Diisopropylbenzoic Acid
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CAS No. 92035-95-5
- Cat. No. CS-0154314
- Purity≥95%
- MDL No.MFCD09965980
*For research and further manufacturing use only, not for direct human use.
Structure of 92035-95-5
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General Information
- CAS No. 92035-95-5
- Cat. No. CS-0154314
- Purity ≥95%
- MDL No. MFCD09965980
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₃H₁₈O₂
- Molecular Weight 206.28
- Synonym(s) 2,6-di(propan-2-yl)benzoic acid
- SMILES CC(C)C1=C(C(=CC=C1)C(C)C)C(=O)O
Description
2,6-Diisopropylbenzoic acid features a sterically hindered aromatic core that enhances metabolic stability and reduces unwanted side reactions. The ortho-isopropyl groups create a shielded carboxylic acid functionality, ideal for applications requiring resistance to nucleophilic attack or enzymatic degradation. This configuration supports use in bioactive molecule design and as a building block in pharmaceutical synthesis where steric protection is critical.
Application
2,6-Diisopropylbenzoic acid serves as a sterically hindered aromatic carboxylic acid widely employed in the synthesis of pharmaceutical intermediates and functional materials. Its ortho-isopropyl groups confer enhanced stability and reduced reactivity toward undesired side reactions, enabling clean derivatization via standard coupling protocols. The compound functions effectively as a building block for bioactive heterocycles and is valued for its ease of purification and robustness under routine reaction conditions.
Synthesis
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Route1
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In-stock
57190-17-7 - ~%
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In-stock
92035-95-5
References
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Warner-Lambert Company Patent: US5807846 A1, 1998 ;
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Route2
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124-38-9 -
In-stock
163704-47-0 - ~81%
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In-stock
92035-95-5
References
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Hunter, Christopher A; Jones, Philip S; Tiger, Pascale M N; Tomas, Salvador Chemical communications (Cambridge, England), 2003 , # 14 p. 1642 - 1643
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Route3
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2078-54-8 - ~%
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In-stock
92035-95-5
References
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Hoffman-La Roche Inc. Patent: US6229011 B1, 2001 ;
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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-P302+P352-P304+P340
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Quality Control
Computational Chemistry Data
- TPSA 37.3
- LogP 3.6316
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 3
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Key Words
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