![Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate structure](/static/products/889/889952-84-5.png)
Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
TL;DR: Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate (CAS 889952-84-5) is a chemical compound with molecular formula C18H22O7 and molecular weight 350.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
Also Known As: A3949/0168210, Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate, methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxotetrahydro-2H-pyran-3-yl]acetate, Methyl 2-(3,4-dimethoxyphenyl)tetrahydro-5,5-dimethyl-4,6-dioxo-2H-pyran-3-acetate, methyl 2-[2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
| Molecular Formula | C18H22O7 |
|---|---|
| Molecular Weight | 350.14 g/mol |
| LogP | 2.0763 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.13657 |
| Heavy Atoms | 25 |
| Complexity | 692.66504 |
Chemical Identifiers
| CAS Number | 889952-84-5 |
|---|---|
| SMILES | CC1(C(=O)C(C(OC1=O)C2=CC(=C(C=C2)OC)OC)CC(=O)OC)C |
Product Overview
Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate (CAS 889952-84-5), with molecular formula C18H22O7 and molecular weight 350.14 g/mol. IUPAC: methyl 2-[2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate.
Chemical Property Profile of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
Property Insights of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
The XLogP value of 2.0763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate. Following Lipinski's Rule of Five, Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate has 0 hydrogen bond donor(s) and 7 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 [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate?
The CAS number of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate is 889952-84-5.
What is the molecular formula of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate?
The molecular formula of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate is C18H22O7.
What is the molecular weight of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate?
The molecular weight of Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate is 350.14 g/mol.
Where can I buy Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate?
You can request a quote for Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.