Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate
TL;DR: Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate (CAS 315237-31-1) is a chemical compound with molecular formula C14H15BrO4 and molecular weight 326.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate
Also Known As: ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate, BIM-0003318.P001, ethyl 6-bromo-5-ethoxy-2-methylbenzofuran-3-carboxylate, F0821-0433, ethyl 6-bromo-5-ethoxy-2-methylbenzo[b]furan-3-carboxylate
| Molecular Formula | C14H15BrO4 |
|---|---|
| Molecular Weight | 326.02 g/mol |
| LogP | 4.07912 |
| Topological Polar Surface Area | 48.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.01538 |
| Heavy Atoms | 19 |
| Complexity | 615.42377 |
Chemical Identifiers
| CAS Number | 315237-31-1 |
|---|---|
| SMILES | CCOC1=C(C=C2C(=C1)C(=C(O2)C)C(=O)OCC)Br |
Product Overview
Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate (CAS 315237-31-1), with molecular formula C14H15BrO4 and molecular weight 326.02 g/mol. IUPAC: ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate
Property Insights of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate
The XLogP value of 4.07912 indicates that Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.67 Ų, Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate 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 Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate?
The CAS number of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate is 315237-31-1.
What is the molecular formula of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate?
The molecular formula of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate is C14H15BrO4.
What is the molecular weight of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate?
The molecular weight of Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate is 326.02 g/mol.
Where can I buy Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate?
You can request a quote for Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-bromo-5-ethoxy-2-methyl-1-benzofuran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.