Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate
TL;DR: Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate (CAS 73751-12-9) is a chemical compound with molecular formula C14H14O5 and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-acetyloxy-3-methyl-1-benzofuran-2-carboxylate
Also Known As: ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate, Ethyl 4-acetoxy-3-methylbenzofuran-2-carboxylate, BAS 01026408, ethyl 4-acetyloxy-3-methyl-1-benzofuran-2-carboxylate, 2-carbethoxy-3-methyl-4-acetoxybenzofuran
| Molecular Formula | C14H14O5 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 2.84322 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.08414 |
| Heavy Atoms | 19 |
| Complexity | 638.5689 |
Chemical Identifiers
| CAS Number | 73751-12-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(O1)C=CC=C2OC(=O)C)C |
Product Overview
Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate (CAS 73751-12-9), with molecular formula C14H14O5 and molecular weight 262.08 g/mol. IUPAC: ethyl 4-acetyloxy-3-methyl-1-benzofuran-2-carboxylate.
Chemical Property Profile of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate
Property Insights of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate
The XLogP value of 2.84322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate 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 Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate?
The CAS number of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate is 73751-12-9.
What is the molecular formula of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate?
The molecular formula of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate is C14H14O5.
What is the molecular weight of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate?
The molecular weight of Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate is 262.08 g/mol.
Where can I buy Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate?
You can request a quote for Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.