Description
4-Propylcyclohexanone (CAS No. 40649-36-3) is a high-purity cyclic ketone with the molecular formula C9H16O and IUPAC name 4-propylcyclohexan-1-one. This compound is a valuable intermediate in organic synthesis, characterized by its clear to pale-yellow appearance and distinct ketone functionality. Ideal for researchers and industrial applications, our 4-Propylcyclohexanone is rigorously tested to ensure ≥98% purity (GC) and is supplied in sealed containers to maintain stability. Suitable for use in pharmaceuticals, fragrances, and specialty chemical synthesis, this product is available in quantities ranging from grams to kilograms to meet both lab-scale and bulk requirements. Store in a cool, dry place away from oxidizing agents.
Properties
- CAS Number: 40649-36-3
- Complexity: 108
- IUPAC Name: 4-propylcyclohexanone
- InChI: InChI=1S/C9H16O/c1-2-3-8-4-6-9(10)7-5-8/h8H,2-7H2,1H3
- InChI Key: NQEDLIZOPMNZMC-UHFFFAOYSA-N
- Exact Mass: 140.120115130
- Molecular Formula: C9H16O
- Molecular Weight: 140.22
- SMILES: CCCC1CCC(=O)CC1
- Topological: 17.1
- Monoisotopic Mass: 140.120115130
- Physical Description: Liquid;
- Synonyms: 4-Propylcyclohexanone, 40649-36-3, 4-n-Propylcyclohexanone, Cyclohexanone, 4-propyl-, DTXSID9048198, 4-propyl-1-cyclohexanone, UNII-9735699W19, DTXCID4028173, EC 406-810-4, 9735699W19, 4nPropylcyclohexanone, 406-810-4, nqedlizopmnzmc-uhfffaoysa-n, 4-propylcyclohexan-1-one, 4-propyl-cyclohexanone, MFCD00058690, 4-n-propyl-cyclohexanone, SCHEMBL178387, SCHEMBL3367229, SCHEMBL6589283, CHEMBL3187245, 4-Propylcyclohexanone, >=99.0%, BCP30887, QBA64936, Tox21_303343, SBB008421, AKOS000120239, CS-W002273, PS-5320, NCGC00257308-01, SY009654, CAS-40649-36-3, DB-009045, NS00030826, P1849, ST50823711, EN300-17912, Q27271956, Z57073962, Cyclohexanone, 4-propyl-;4-n-Propylcyclohexanone;4-propylcyclohexan-1-one
Application
4-Propylcyclohexanone serves as a key intermediate in the synthesis of fine chemicals and pharmaceutical precursors. Its cyclohexanone core makes it useful in the production of fragrances and flavoring agents. Researchers also employ it in catalytic hydrogenation studies and as a building block for complex organic frameworks. The propyl side chain enhances its utility in hydrophobic interactions for material science applications.
Safety and Hazards
GHS Hazard Statements
- H315: Causes skin irritation [Warning Skin corrosion/irritation]
- H412: Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statements
- P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, and P501
Hazard Classes and Categories
- Skin Irrit. 2 (100%)
- Aquatic Chronic 3 (100%)
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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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