Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate
TL;DR: Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate (CAS 104227-38-5) is a chemical compound with molecular formula C9H17O6P and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-dimethoxyphosphoryl-5-oxohexanoate
Also Known As: Methyl 6-dimethoxyphosphoryl-5-oxo-hexanoate, Methyl 6-dimethoxyphosphoryl-5-oxohexanoate, METHYL 6-(DIMETHOXYPHOSPHORYL)-5-OXOHEXANOATE, Dimethyl-5-mehtoxycarbonyl-2-oxopentyl phosphonate, methyl6-dimethoxyphosphoryl-5-oxohexanoate
| Molecular Formula | C9H17O6P |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | 1.3847 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 252.07628 |
| Heavy Atoms | 16 |
| Complexity | 279.7238 |
Chemical Identifiers
| CAS Number | 104227-38-5 |
|---|---|
| SMILES | COC(=O)CCCC(=O)CP(=O)(OC)OC |
Product Overview
Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate (CAS 104227-38-5), with molecular formula C9H17O6P and molecular weight 252.08 g/mol. IUPAC: methyl 6-dimethoxyphosphoryl-5-oxohexanoate.
Chemical Property Profile of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate
Property Insights of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate
The XLogP value of 1.3847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate. Following Lipinski's Rule of Five, Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate 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 Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate?
The CAS number of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate is 104227-38-5.
What is the molecular formula of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate?
The molecular formula of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate is C9H17O6P.
What is the molecular weight of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate?
The molecular weight of Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate is 252.08 g/mol.
Where can I buy Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate?
You can request a quote for Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 6-(dimethoxyphosphoryl)-5-oxohexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.