Lot numbers can be found on the outside label of a product:
Tetrahydro-2H-pyran-4-ylacetic acid
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CAS No. 85064-61-5
- Cat. No. CS-W001906
- Purity≥97%
- MDL No.MFCD01631204
*For research and further manufacturing use only, not for direct human use.
Structure of 85064-61-5
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General Information
- CAS No. 85064-61-5
- Cat. No. CS-W001906
- Purity ≥97%
- MDL No. MFCD01631204
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₁₂O₃
- Molecular Weight 144.17
- Synonym(s) Tetrahydropyranyl-4-aceticacid
- SMILES OC(=O)CC1CCOCC1
Description
Tetrahydro-2H-pyran-4-ylacetic acid features a hydrolytically stable tetrahydropyran ring that confers enhanced solubility and metabolic stability. This scaffold integrates a pendant acetic acid group, enabling direct conjugation or derivatization in synthetic workflows. The protected alcohol moiety facilitates selective transformations under mild conditions.
Application
Tetrahydro-2H-pyran-4-ylacetic acid serves as a versatile building block in medicinal chemistry, offering a protected hydroxyl group and a carboxylic acid functionality for orthogonal derivatization. The tetrahydropyranyl (THP) moiety provides excellent stability under acidic conditions and facilitates selective deprotection, enabling controlled functionalization. This compound enables efficient synthesis of complex heterocyclic scaffolds and bioactive intermediates, with favorable handling properties and compatibility in standard peptide coupling and conjugation workflows.
Synthesis
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Route1
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156002-64-1 - ~%
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In-stock
85064-61-5
References
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WO2004/113298 A1, ; Page 30 ;
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Route2
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In-stock
103260-44-2 - ~%
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In-stock
85064-61-5
References
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Ghosh, Arun K.; Thompson, Wayne J.; Holloway, M. Katharine; McKee, Sean P.; Duong, Tien T.; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 16 p. 2300 - 2310
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References
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EP434365 A2, ;
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Safety Information
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GHS Pictogram :
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GHS No : GHS05
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Signal Word : Danger
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UN#: 1759
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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-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 46.53
- LogP 0.8877
- H_Acceptors 2
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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