Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate
TL;DR: Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate (CAS 7287-40-3) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-hydroxy-2-methyl-1-benzofuran-3-carboxylate
Also Known As: ethyl 5-hydroxy-2-methyl-1-benzofuran-3-carboxylate, ethyl 5-hydroxy-2-methylbenzofuran-3-carboxylate, Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate, 2-methyl-3-carbethoxy-5-hydroxybenzofuran, ethyl 5-hydroxy-2-methyl-benzofuran-3-carboxylate
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 7287-40-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)C |
| InChIKey | KSNVFCJUBJUTPF-UHFFFAOYSA-N |
Product Overview
Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate (CAS 7287-40-3), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: ethyl 5-hydroxy-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate
Property Insights of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate. With a topological polar surface area (TPSA) of 59.7 Ų, Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate has 1 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 5-hydroxy-2-methyl-3-benzofurancarboxylate?
The CAS number of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate is 7287-40-3.
What is the molecular formula of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate?
The molecular formula of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate is C12H12O4.
What is the molecular weight of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate?
The molecular weight of Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate is 220.07 g/mol.
Where can I buy Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate?
You can request a quote for Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-hydroxy-2-methyl-3-benzofurancarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.