Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate
TL;DR: Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate (CAS 72830-04-7) is a chemical compound with molecular formula C15H20O6 and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propanoate
Also Known As: EINECS 276-925-0, Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate, ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propanoate, ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)-propionate, alpha-Formyl-3,4,5-trimethoxybenzenepropanoic acid ethyl ester
| Molecular Formula | C15H20O6 |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 1.6331 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.12598 |
| Heavy Atoms | 21 |
| Complexity | 471.93237 |
Chemical Identifiers
| CAS Number | 72830-04-7 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CC(=C(C(=C1)OC)OC)OC)C=O |
Product Overview
Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate (CAS 72830-04-7), with molecular formula C15H20O6 and molecular weight 296.13 g/mol. IUPAC: ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propanoate.
Chemical Property Profile of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate
Property Insights of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate
The XLogP value of 1.6331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate. Following Lipinski's Rule of Five, Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate 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 Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate?
The CAS number of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate is 72830-04-7.
What is the molecular formula of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate?
The molecular formula of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate is C15H20O6.
What is the molecular weight of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate?
The molecular weight of Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate is 296.13 g/mol.
Where can I buy Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate?
You can request a quote for Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-formyl-3-(3,4,5-trimethoxyphenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.