Indan-1,2,3-trione
TL;DR: Indan-1,2,3-trione (CAS 938-24-9) is a chemical compound with molecular formula C9H4O3 and molecular weight 160.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
indene-1,2,3-trione
Also Known As: Indantrione, 1H-Indene-1,2,3-trione, Indan-1,2,3-trione, Triketoindan, indene-1,2,3-trione
| Molecular Formula | C9H4O3 |
|---|---|
| Molecular Weight | 160.02 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.01604 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 938-24-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=O)C2=O |
| InChIKey | WVZWEMOFSIEEMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indan-1,2,3-trione (CAS 938-24-9), with molecular formula C9H4O3 and molecular weight 160.02 g/mol. IUPAC: indene-1,2,3-trione.
Chemical Property Profile of Indan-1,2,3-trione
Property Insights of Indan-1,2,3-trione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indan-1,2,3-trione. With a topological polar surface area (TPSA) of 51.2 Ų, Indan-1,2,3-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indan-1,2,3-trione 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 Indan-1,2,3-trione?
The CAS number of Indan-1,2,3-trione is 938-24-9.
What is the molecular formula of Indan-1,2,3-trione?
The molecular formula of Indan-1,2,3-trione is C9H4O3.
What is the molecular weight of Indan-1,2,3-trione?
The molecular weight of Indan-1,2,3-trione is 160.02 g/mol.
Where can I buy Indan-1,2,3-trione?
You can request a quote for Indan-1,2,3-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indan-1,2,3-trione?
Yes, KEHONG BIO provides custom synthesis services for Indan-1,2,3-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.