二苯茚酮
TL;DR: 二苯茚酮 (CAS 82-66-6) is a chemical compound with molecular formula C23H16O3 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯茚酮
2-(2,2-diphenylacetyl)indene-1,3-dione
Also Known As: Diphacinone, DIPHENADIONE, Diphenacin, Didandin, Diphenandione
| Molecular Formula | C23H16O3 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.10995 |
| Heavy Atoms | 26 |
| Complexity | 512.0 |
| Melting Point | 295 to 147.2 °C |
| Density | Bulk density: 1.87 g/mL |
| Solubility | In water, 0.3 mg/L, temp not specified |
| Vapor Pressure | VP: 1.2X10-8 mm Hg |
| Refractive Index | 1.670 C |
Chemical Identifiers
| CAS Number | 82-66-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3C(=O)C4=CC=CC=C4C3=O |
| InChIKey | JYGLAHSAISAEAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯茚酮 (CAS 82-66-6), with molecular formula C23H16O3 and molecular weight 340.11 g/mol. IUPAC: 2-(2,2-diphenylacetyl)indene-1,3-dione.
Chemical Property Profile of 二苯茚酮
Property Insights of 二苯茚酮
The XLogP value of 3.7 indicates that 二苯茚酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 二苯茚酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯茚酮 has 0 hydrogen bond donor(s) and 3 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 二苯茚酮?
The CAS number of 二苯茚酮 is 82-66-6.
What is the molecular formula of 二苯茚酮?
The molecular formula of 二苯茚酮 is C23H16O3.
What is the molecular weight of 二苯茚酮?
The molecular weight of 二苯茚酮 is 340.11 g/mol.
Where can I buy 二苯茚酮?
You can request a quote for 二苯茚酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯茚酮?
Yes, KEHONG BIO provides custom synthesis services for 二苯茚酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.