Lot numbers can be found on the outside label of a product:
1-Hydroxycyclobutanecarboxylic acid
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CAS No. 41248-13-9
- Cat. No. CS-0052945
- Purity≥97%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 41248-13-9
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General Information
- CAS No. 41248-13-9
- Cat. No. CS-0052945
- Purity ≥97%
- MDL No. None
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₅H₈O₃
- Molecular Weight 116.12
- Synonym(s) 1-Hydroxy-cyclobutanecarboxylic acid
- SMILES OC(=O)C1(O)CCC1
Description
1-Hydroxycyclobutanecarboxylic acid features a strained cyclobutane ring bearing both carboxylic acid and hydroxyl functionalities, enabling direct integration into diverse synthetic scaffolds. The adjacent polar groups enhance solubility in protic solvents while maintaining stability under standard bench conditions. This bifunctional architecture supports applications in medicinal chemistry and polymer side-chain modification.
Application
1-Hydroxycyclobutanecarboxylic acid serves as a versatile building block for cyclobutane-containing scaffolds in medicinal chemistry and materials science. Its carboxylic acid and hydroxyl functionalities enable direct derivatization via esterification, amidation, or protection strategies. The molecule exhibits sufficient bench stability for routine handling and demonstrates compatibility with standard coupling reagents, facilitating integration into multi-step syntheses of bioactive compounds and functional polymers.
Synthesis
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Route1
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In-stock
3008-40-0 - ~89%
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In-stock
41248-13-9
References
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COUNCIL OF SCIENTIFIC and INDUSTRIAL RESEARCH Patent: US2010/249451 A1, 2010 ; Location in patent: Page/Page column 3 ;
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Route2
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55767-58-3 - ~97%
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In-stock
41248-13-9
References
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Brown, Matthew F.; Mitton-Fry, Mark J.; Arcari, Joel T.; Barham, Rose; Casavant, Jeffrey; Gerstenberger, Brian S.; Han, Seungil; Hardink, Joel R.; Harris, Thomas M.; Hoang, Thuy; Huband, Michael D.; Lall, Manjinder S.; Lemmon, M. Megan; Li, Chao; Lin, Jian; McCurdy, Sandra P.; McElroy, Eric; McPherson, Craig; Marr, Eric S.; Mueller, John P.; Mullins, Lisa; Nikitenko, Antonia A.; Noe, Mark C.; Penzien, Joseph; Plummer, Mark S.; Schuff, Brandon P.; Shanmugasundaram, Veerabahu; Starr, Jeremy T.; Sun, Jianmin; Tomaras, Andrew; Young, Jennifer A.; Zaniewski, Richard P. Journal of Medicinal Chemistry, 2013 , vol. 56, # 13 p. 5541 - 5552
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Route3
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In-stock
3721-95-7 - ~97%
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In-stock
41248-13-9
References
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Estieu, Karine; Ollivier, Jean; Salauen, Jacques Tetrahedron, 1998 , vol. 54, # 28 p. 8075 - 8090
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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#: 3261
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Class : 8
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Packing Group : Ⅲ
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Hazard Statements : H302-H315-H318-H335
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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 57.53
- LogP -0.014
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 1
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Key Words
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