Lot numbers can be found on the outside label of a product:
1-Cyclohexyl-2,2,2-trifluoroethan-1-one
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CAS No. 6302-04-1
- Cat. No. CS-0271605
- Purity≥95%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 6302-04-1
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General Information
- CAS No. 6302-04-1
- Cat. No. CS-0271605
- Purity ≥95%
- MDL No. None
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₁₁F₃O
- Molecular Weight 180.17
- Synonym(s) 1-Cyclohexyl-2,2,2-trifluoro-ethanone
- SMILES C1CCC(CC1)C(=O)C(F)(F)F
Description
1-Cyclohexyl-2,2,2-trifluoroethan-1-one is a bench-stable ketone featuring a trifluoromethyl group that enhances electrophilicity at the carbonyl center. This sterically accessible motif integrates readily into synthetic pathways requiring strong electron-withdrawing effects, enabling efficient coupling reactions under mild conditions.
Application
1-Cyclohexyl-2,2,2-trifluoroethan-1-one serves as a versatile building block in synthetic organic chemistry, enabling the efficient construction of fluorinated heterocycles and pharmaceutically relevant scaffolds. Its trifluoromethyl ketone functionality exhibits enhanced electrophilicity and metabolic stability, facilitating nucleophilic additions and condensation reactions under mild conditions. The cyclohexyl group provides steric bulk and improved solubility, contributing to bench stability and ease of purification in multi-step syntheses.
Synthesis
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Route1
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In-stock
107018-38-2 - ~77%
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In-stock
6302-04-1
References
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Linderman, Russell J.; Graves, David M. Journal of Organic Chemistry, 1989 , vol. 54, # 3 p. 661 - 668
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References
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Wiedemann, Juergen; Heiner, Thomas; Mloston, Gregorz; Prakash, G.K. Surya; Olah, George A. Angewandte Chemie - International Edition, 1998 , vol. 37, # 6 p. 820 - 821
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Route3
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383-63-1 -
931-51-1
- ~65%
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In-stock
6302-04-1
References
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Creary, Xavier Journal of Organic Chemistry, 1987 , vol. 52, # 22 p. 5026 - 5030
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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 : H315-H319-H335
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Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 17.07
- LogP 2.6981
- H_Acceptors 1
- H_Donors 0
- Rotatable_Bonds 1
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Key Words
- 1-Cyclohexyl-2,2,2-trifluoroethan-1-one sigma1-Cyclohexyl-2,2,2-trifluoroethan-1-one manufacturer1-Cyclohexyl-2,2,2-trifluoroethan-1-one price1-Cyclohexyl-2,2,2-trifluoroethan-1-one structure1-Cyclohexyl-2,2,2-trifluoroethan-1-one SDSbuy 1-Cyclohexyl-2,2,2-trifluoroethan-1-one1-Cyclohexyl-2,2,2-trifluoroethan-1-one supplier1-Cyclohexyl-2,2,2-trifluoroethan-1-one uses1-Cyclohexyl-2,2,2-trifluoroethan-1-one molecular weightprice of 1-Cyclohexyl-2,2,2-trifluoroethan-1-one1-Cyclohexyl-2,2,2-trifluoroethan-1-one chemical name formula of 1-Cyclohexyl-2,2,2-trifluoroethan-1-one