4,4-Diphenylcyclohexanone
TL;DR: 4,4-Diphenylcyclohexanone (CAS 4528-68-1) is a chemical compound with molecular formula C18H18O and molecular weight 250.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-diphenylcyclohexan-1-one
Also Known As: 4,4-Diphenylcyclohexanone, 4,4-diphenylcyclohexan-1-one, Cyclohexanone, 4,4-diphenyl-, Cyclohexanone,4-diphenyl, Cyclohexanone,4-diphenyl-
| Molecular Formula | C18H18O |
|---|---|
| Molecular Weight | 250.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.13577 |
| Heavy Atoms | 19 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 4528-68-1 |
|---|---|
| SMILES | C1CC(CCC1=O)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | QJPHZZUBQAASNR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4-Diphenylcyclohexanone (CAS 4528-68-1), with molecular formula C18H18O and molecular weight 250.14 g/mol. IUPAC: 4,4-diphenylcyclohexan-1-one.
Chemical Property Profile of 4,4-Diphenylcyclohexanone
Property Insights of 4,4-Diphenylcyclohexanone
The XLogP value of 3.8 indicates that 4,4-Diphenylcyclohexanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4,4-Diphenylcyclohexanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Diphenylcyclohexanone 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 4,4-Diphenylcyclohexanone?
The CAS number of 4,4-Diphenylcyclohexanone is 4528-68-1.
What is the molecular formula of 4,4-Diphenylcyclohexanone?
The molecular formula of 4,4-Diphenylcyclohexanone is C18H18O.
What is the molecular weight of 4,4-Diphenylcyclohexanone?
The molecular weight of 4,4-Diphenylcyclohexanone is 250.14 g/mol.
Where can I buy 4,4-Diphenylcyclohexanone?
You can request a quote for 4,4-Diphenylcyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Diphenylcyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Diphenylcyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.