(1,1'-Bicyclohexyl)-4-one
TL;DR: (1,1'-Bicyclohexyl)-4-one (CAS 92-68-2) is a chemical compound with molecular formula C12H20O and molecular weight 180.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyclohexylcyclohexan-1-one
Also Known As: 4-Cyclohexylcyclohexanone, [1,1'-Bi(cyclohexan)]-4-one, 4-cyclohexylcyclohexan-1-one, 4-Phenylcyclohexanone, [1,1'-Bicyclohexyl]-4-one
| Molecular Formula | C12H20O |
|---|---|
| Molecular Weight | 180.15 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.15141 |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 92-68-2 |
|---|---|
| SMILES | C1CCC(CC1)C2CCC(=O)CC2 |
| InChIKey | JLYNSPSTPQAEAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,1'-Bicyclohexyl)-4-one (CAS 92-68-2), with molecular formula C12H20O and molecular weight 180.15 g/mol. IUPAC: 4-cyclohexylcyclohexan-1-one.
Chemical Property Profile of (1,1'-Bicyclohexyl)-4-one
Property Insights of (1,1'-Bicyclohexyl)-4-one
The XLogP value of 3.4 indicates that (1,1'-Bicyclohexyl)-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, (1,1'-Bicyclohexyl)-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1'-Bicyclohexyl)-4-one 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
Frequently Asked Questions
What is the CAS number of (1,1'-Bicyclohexyl)-4-one?
The CAS number of (1,1'-Bicyclohexyl)-4-one is 92-68-2.
What is the molecular formula of (1,1'-Bicyclohexyl)-4-one?
The molecular formula of (1,1'-Bicyclohexyl)-4-one is C12H20O.
What is the molecular weight of (1,1'-Bicyclohexyl)-4-one?
The molecular weight of (1,1'-Bicyclohexyl)-4-one is 180.15 g/mol.
Where can I buy (1,1'-Bicyclohexyl)-4-one?
You can request a quote for (1,1'-Bicyclohexyl)-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1'-Bicyclohexyl)-4-one?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-Bicyclohexyl)-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.