4,5-Diphenyloctane-2,7-dione
TL;DR: 4,5-Diphenyloctane-2,7-dione (CAS 7028-44-6) is a chemical compound with molecular formula C20H22O2 and molecular weight 294.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diphenyloctane-2,7-dione
Also Known As: 4,5-diphenyl-2,7-octanedione, 4,5-diphenyloctane-2,7-dione, 4,5-Diphenyl-octane-2,7-dione, BAS 00614554, 2,7-Octanedione, 4,5-diphenyl-, (4R,5S)-rel-
| Molecular Formula | C20H22O2 |
|---|---|
| Molecular Weight | 294.16 g/mol |
| LogP | 4.5122 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 294.162 |
| Heavy Atoms | 22 |
| Complexity | 559.1702 |
Chemical Identifiers
| CAS Number | 7028-44-6 |
|---|---|
| SMILES | CC(=O)CC(C1=CC=CC=C1)C(CC(=O)C)C2=CC=CC=C2 |
Product Overview
4,5-Diphenyloctane-2,7-dione (CAS 7028-44-6), with molecular formula C20H22O2 and molecular weight 294.16 g/mol. IUPAC: 4,5-diphenyloctane-2,7-dione.
Chemical Property Profile of 4,5-Diphenyloctane-2,7-dione
Property Insights of 4,5-Diphenyloctane-2,7-dione
The XLogP value of 4.5122 indicates that 4,5-Diphenyloctane-2,7-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 4,5-Diphenyloctane-2,7-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Diphenyloctane-2,7-dione has 0 hydrogen bond donor(s) and 2 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 4,5-Diphenyloctane-2,7-dione?
The CAS number of 4,5-Diphenyloctane-2,7-dione is 7028-44-6.
What is the molecular formula of 4,5-Diphenyloctane-2,7-dione?
The molecular formula of 4,5-Diphenyloctane-2,7-dione is C20H22O2.
What is the molecular weight of 4,5-Diphenyloctane-2,7-dione?
The molecular weight of 4,5-Diphenyloctane-2,7-dione is 294.16 g/mol.
Where can I buy 4,5-Diphenyloctane-2,7-dione?
You can request a quote for 4,5-Diphenyloctane-2,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Diphenyloctane-2,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Diphenyloctane-2,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.