Dicyclohexyl ketone
TL;DR: Dicyclohexyl ketone (CAS 119-60-8) is a chemical compound with molecular formula C13H22O and molecular weight 194.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dicyclohexylmethanone
Also Known As: Dicyclohexyl ketone, Dicyclohexylmethanone, Cyclohexyl ketone, Methanone, dicyclohexyl-, Cyclohexane ketone
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H22O |
| Molecular Weight | 194.16707 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.16707 Da |
| Heavy Atoms | 14 |
| Complexity | 165.0 |
| SMILES | C1CCC(CC1)C(=O)C2CCCCC2 |
| InChIKey | TWXWPPKDQOWNSX-UHFFFAOYSA-N |
Product Description
Applications: Dicyclohexyl ketone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dicyclohexyl ketone (CAS 119-60-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, Dicyclohexyl ketone (CAS 119-60-8) has the molecular formula C13H22O and a molecular weight of 194.17 g/mol. It is also known as Dicyclohexyl ketone and Dicyclohexylmethanone.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Dicyclohexyl ketone
Property Insights of Dicyclohexyl ketone
The XLogP value of 4.1 indicates that Dicyclohexyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Dicyclohexyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dicyclohexyl ketone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dicyclohexyl ketone?
The CAS number of Dicyclohexyl ketone is 119-60-8.
What is the molecular formula of Dicyclohexyl ketone?
The molecular formula of Dicyclohexyl ketone is C13H22O.
What is the molecular weight of Dicyclohexyl ketone?
The molecular weight of Dicyclohexyl ketone is 194.16707 g/mol.
What are the applications of Dicyclohexyl ketone?
Dicyclohexyl ketone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dicyclohexyl...
Where can I buy Dicyclohexyl ketone?
You can request a quote for Dicyclohexyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dicyclohexyl ketone?
Yes, CoreyChem provides custom synthesis services for Dicyclohexyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.