1,2-茚满二酮
TL;DR: 1,2-茚满二酮 (CAS 16214-27-0) is a chemical compound with molecular formula C9H6O2 and molecular weight 146.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-茚满二酮
3H-indene-1,2-dione
Also Known As: 1H-Indene-1,2(3H)-dione, 1,2-Indanedione, Indan-1,2-dione, 1,2-Indandione, Indandione
| Molecular Formula | C9H6O2 |
|---|---|
| Molecular Weight | 146.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.03677 |
| Heavy Atoms | 11 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 16214-27-0 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)C1=O |
| InChIKey | WFFZGYRTVIPBFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-茚满二酮 (CAS 16214-27-0), with molecular formula C9H6O2 and molecular weight 146.04 g/mol. IUPAC: 3H-indene-1,2-dione.
Chemical Property Profile of 1,2-茚满二酮
Property Insights of 1,2-茚满二酮
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-茚满二酮. With a topological polar surface area (TPSA) of 34.1 Ų, 1,2-茚满二酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-茚满二酮 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 1,2-茚满二酮?
The CAS number of 1,2-茚满二酮 is 16214-27-0.
What is the molecular formula of 1,2-茚满二酮?
The molecular formula of 1,2-茚满二酮 is C9H6O2.
What is the molecular weight of 1,2-茚满二酮?
The molecular weight of 1,2-茚满二酮 is 146.04 g/mol.
Where can I buy 1,2-茚满二酮?
You can request a quote for 1,2-茚满二酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-茚满二酮?
Yes, KEHONG BIO provides custom synthesis services for 1,2-茚满二酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.