Methyl 3,4,5-triethoxybenzoate
TL;DR: Methyl 3,4,5-triethoxybenzoate (CAS 39666-77-8) is a chemical compound with molecular formula C14H20O5 and molecular weight 268.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,4,5-triethoxybenzoate
Also Known As: methyl 3,4,5-triethoxybenzoate, 3,4,5-Triethoxybenzoic acid methyl ester
| Molecular Formula | C14H20O5 |
|---|---|
| Molecular Weight | 268.13 g/mol |
| LogP | 2.6693 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.13107 |
| Heavy Atoms | 19 |
| Complexity | 400.83966 |
Chemical Identifiers
| CAS Number | 39666-77-8 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC |
Product Overview
Methyl 3,4,5-triethoxybenzoate (CAS 39666-77-8), with molecular formula C14H20O5 and molecular weight 268.13 g/mol. IUPAC: methyl 3,4,5-triethoxybenzoate.
Chemical Property Profile of Methyl 3,4,5-triethoxybenzoate
Property Insights of Methyl 3,4,5-triethoxybenzoate
The XLogP value of 2.6693 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3,4,5-triethoxybenzoate. With a topological polar surface area (TPSA) of 53.99 Ų, Methyl 3,4,5-triethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3,4,5-triethoxybenzoate has 0 hydrogen bond donor(s) and 5 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 3,4,5-triethoxybenzoate?
The CAS number of Methyl 3,4,5-triethoxybenzoate is 39666-77-8.
What is the molecular formula of Methyl 3,4,5-triethoxybenzoate?
The molecular formula of Methyl 3,4,5-triethoxybenzoate is C14H20O5.
What is the molecular weight of Methyl 3,4,5-triethoxybenzoate?
The molecular weight of Methyl 3,4,5-triethoxybenzoate is 268.13 g/mol.
Where can I buy Methyl 3,4,5-triethoxybenzoate?
You can request a quote for Methyl 3,4,5-triethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,4,5-triethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,4,5-triethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.