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 |
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.
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.