Indium-111 tropolone
TL;DR: Indium-111 tropolone (CAS 80233-75-6) is a chemical compound with molecular formula C21H15InO6 and molecular weight 473.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
indium-111(3+);tris(7-oxocyclohepta-1,3,5-trien-1-olate)
Also Known As: Indium-111 tropolone, In-Tropolonate, Indium In 111 tropolone, indium-111(3+); 7-oxocyclohepta-1,3,5-trien-1-olate, Indium-111In, tris(2-(hydroxy-kappaO)-2,4,6-cycloheptatrien-1-onato-kappaO)-, (OC-6-11)-
| Molecular Formula | C21H15InO6 |
|---|---|
| Molecular Weight | 473.99 g/mol |
| LogP | -0.0196 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 473.99197 |
| Heavy Atoms | 28 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 80233-75-6 |
|---|---|
| SMILES | C1=CC=C(C(=O)C=C1)[O-].C1=CC=C(C(=O)C=C1)[O-].C1=CC=C(C(=O)C=C1)[O-].[111In+3] |
| InChIKey | KSMJSFRPGYWEOD-FZTWWWDYSA-K |
Product Overview
Indium-111 tropolone (CAS 80233-75-6), with molecular formula C21H15InO6 and molecular weight 473.99 g/mol. IUPAC: indium-111(3+);tris(7-oxocyclohepta-1,3,5-trien-1-olate).
Chemical Property Profile of Indium-111 tropolone
Property Insights of Indium-111 tropolone
The XLogP value of -0.0196 indicates that Indium-111 tropolone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Indium-111 tropolone. Following Lipinski's Rule of Five, Indium-111 tropolone has 0 hydrogen bond donor(s) and 6 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 Indium-111 tropolone?
The CAS number of Indium-111 tropolone is 80233-75-6.
What is the molecular formula of Indium-111 tropolone?
The molecular formula of Indium-111 tropolone is C21H15InO6.
What is the molecular weight of Indium-111 tropolone?
The molecular weight of Indium-111 tropolone is 473.99 g/mol.
Where can I buy Indium-111 tropolone?
You can request a quote for Indium-111 tropolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indium-111 tropolone?
Yes, KEHONG BIO provides custom synthesis services for Indium-111 tropolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.