5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid
TL;DR: 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid (CAS 851903-92-9) is a chemical compound with molecular formula C12H14O4 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid
Also Known As: 5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid, 5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-carboxylic Acid
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 2.1069 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 425.2721 |
Chemical Identifiers
| CAS Number | 851903-92-9 |
|---|---|
| SMILES | CCOC1=C(C=C2C(=C1)CC(O2)C)C(=O)O |
Product Overview
5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid (CAS 851903-92-9), with molecular formula C12H14O4 and molecular weight 222.09 g/mol. IUPAC: 5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid.
Chemical Property Profile of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid
Property Insights of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid
The XLogP value of 2.1069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid?
The CAS number of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid is 851903-92-9.
What is the molecular formula of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid?
The molecular formula of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid is C12H14O4.
What is the molecular weight of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid?
The molecular weight of 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid is 222.09 g/mol.
Where can I buy 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid?
You can request a quote for 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.