Description
4-Ethylcyclohexanone (CAS No. 5441-51-0) is a high-purity cyclic ketone with the molecular formula C8H14O. This organic compound, also known by its IUPAC name 4-ethylcyclohexan-1-one, features a six-membered cyclohexane ring substituted with an ethyl group at the 4-position and a ketone functional group. It is a versatile intermediate widely used in organic synthesis, fragrance formulation, and pharmaceutical research. Our product is rigorously tested to ensure optimal purity and consistency, making it ideal for laboratory and industrial applications. Available in various quantities, this compound is packaged under inert conditions to maintain stability and shelf life.
Properties
- CAS Number: 5441-51-0
- Complexity: 97.1
- IUPAC Name: 4-ethylcyclohexanone
- InChI: InChI=1S/C8H14O/c1-2-7-3-5-8(9)6-4-7/h7H,2-6H2,1H3
- InChI Key: OKSDJGWHKXFVME-UHFFFAOYSA-N
- Exact Mass: 126.104465066
- Molecular Formula: C8H14O
- Molecular Weight: 126.20
- SMILES: CCC1CCC(=O)CC1
- Topological: 17.1
- Monoisotopic Mass: 126.104465066
- Synonyms: 4-Ethylcyclohexanone, 5441-51-0, Cyclohexanone, 4-ethyl-, EINECS 226-629-2, DTXSID20202807, NSC 21120, DTXCID10125298, 226-629-2, 4-ethylcyclohexan-1-one, NSC-21120, NSC21120, MFCD00001644, 4-Ethyl-cyclohexanone, 4-Ethyl-1-cyclohexanone, 4-Ethylcyclohexanone, 97%, 6ERC99KWN8, SCHEMBL87369, SCHEMBL6591999, SCHEMBL27507043, OKSDJGWHKXFVME-UHFFFAOYSA-, SBB059272, AKOS000119710, CS-W011153, DS-14332, DB-009039, CS-0226152, E0398, NS00022347, ST51037923, EN300-19813, N10368, Z104475572, InChI=1/C8H14O/c1-2-7-3-5-8(9)6-4-7/h7H,2-6H2,1H3
Application
4-Ethylcyclohexanone serves as a key intermediate in the synthesis of fragrances, agrochemicals, and pharmaceuticals. It is commonly employed in organic reactions such as reductions, oxidations, and condensations. Researchers utilize this compound in the development of novel cyclohexane-based derivatives for material science and medicinal chemistry applications.
Safety and Hazards
GHS Hazard Statements
- H227 (33.3%): Combustible liquid [Warning Flammable liquids]
- H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
- H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]
- H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
- H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
- H412 (33.3%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statements
- P210, P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501
Hazard Classes and Categories
- Flam. Liq. 4 (33.3%)
- Skin Irrit. 2 (100%)
- Skin Sens. 1 (33.3%)
- Eye Irrit. 2A (66.7%)
- STOT SE 3 (33.3%)
- Aquatic Chronic 3 (33.3%)
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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.


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