![3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester structure](/static/products/408/40800-98-4.png)
3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester
TL;DR: 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester (CAS 40800-98-4) is a chemical compound with molecular formula C17H14O4 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-hydroxyphenyl)methyl]-1-benzofuran-3-carboxylate
Also Known As: 2-[methyl]-3-benzofurancarboxylicacidmethylester, 2-[ methyl]-3-benzofurancarboxylicacidmethylester, Methyl 2-(2-hydroxybenzyl)-1-benzofuran-3-carboxylate, methyl 2-[(2-hydroxyphenyl)methyl]-1-benzofuran-3-carboxylate, Methyl 2-(2-hydroxybenzyl)-1-benzofuran-3-carboxylate #
| Molecular Formula | C17H14O4 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.0892 |
| Heavy Atoms | 21 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 40800-98-4 |
|---|---|
| SMILES | COC(=O)C1=C(OC2=CC=CC=C21)CC3=CC=CC=C3O |
| InChIKey | DHIUUROFLLLLKR-UHFFFAOYSA-N |
Product Overview
3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester (CAS 40800-98-4), with molecular formula C17H14O4 and molecular weight 282.09 g/mol. IUPAC: methyl 2-[(2-hydroxyphenyl)methyl]-1-benzofuran-3-carboxylate.
Chemical Property Profile of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester
Property Insights of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester
The XLogP value of 3.8 indicates that 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.7 Ų, 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester 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 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester?
The CAS number of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester is 40800-98-4.
What is the molecular formula of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester?
The molecular formula of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester is C17H14O4.
What is the molecular weight of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester?
The molecular weight of 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester is 282.09 g/mol.
Where can I buy 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester?
You can request a quote for 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzofurancarboxylic acid, 2-[(2-hydroxyphenyl)methyl]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.