Methyl 6,8-dioxononanoate
TL;DR: Methyl 6,8-dioxononanoate (CAS 61448-25-7) is a chemical compound with molecular formula C10H16O4 and molecular weight 200.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6,8-dioxononanoate
Also Known As: Methyl 6,8-dioxononanoate, 6,8-Dioxononanoic acid methyl ester, Nonanoic acid,6,8-dioxo-,methyl ester, Nonanoic acid, 6,8-dioxo-, methyl ester, RefChem:356205
| Molecular Formula | C10H16O4 |
|---|---|
| Molecular Weight | 200.10 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 200.10486 |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 61448-25-7 |
|---|---|
| SMILES | CC(=O)CC(=O)CCCCC(=O)OC |
| InChIKey | JUBRHNJQHPPNQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 6,8-dioxononanoate (CAS 61448-25-7), with molecular formula C10H16O4 and molecular weight 200.10 g/mol. IUPAC: methyl 6,8-dioxononanoate.
Chemical Property Profile of Methyl 6,8-dioxononanoate
Property Insights of Methyl 6,8-dioxononanoate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 6,8-dioxononanoate. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 6,8-dioxononanoate. Following Lipinski's Rule of Five, Methyl 6,8-dioxononanoate has 0 hydrogen bond donor(s) and 4 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 Methyl 6,8-dioxononanoate?
The CAS number of Methyl 6,8-dioxononanoate is 61448-25-7.
What is the molecular formula of Methyl 6,8-dioxononanoate?
The molecular formula of Methyl 6,8-dioxononanoate is C10H16O4.
What is the molecular weight of Methyl 6,8-dioxononanoate?
The molecular weight of Methyl 6,8-dioxononanoate is 200.10 g/mol.
Where can I buy Methyl 6,8-dioxononanoate?
You can request a quote for Methyl 6,8-dioxononanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 6,8-dioxononanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 6,8-dioxononanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.