[2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester
TL;DR: [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester (CAS 5896-31-1) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(5-methylfuran-2-yl)furan-3-carboxylate
Also Known As: methyl 5'-methyl-[2,2'-bifuran]-3-carboxylate, [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester, methyl 2-(5-methylfuran-2-yl)furan-3-carboxylate, 5'-Methyl-(2,2'-bifuran)-3-carboxylic acid methyl ester, 5 -Methyl-(2,2 -bifuran)-3-carboxylic acid methyl ester
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 5896-31-1 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=C(C=CO2)C(=O)OC |
| InChIKey | DNVZLXZJRGLJJK-UHFFFAOYSA-N |
Product Overview
[2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester (CAS 5896-31-1), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: methyl 2-(5-methylfuran-2-yl)furan-3-carboxylate.
Chemical Property Profile of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester
Property Insights of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester 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 [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester?
The CAS number of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester is 5896-31-1.
What is the molecular formula of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester?
The molecular formula of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester is C11H10O4.
What is the molecular weight of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester?
The molecular weight of [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester is 206.06 g/mol.
Where can I buy [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester?
You can request a quote for [2,2'-Bifuran]-3-carboxylic acid, 5'-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 [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for [2,2'-Bifuran]-3-carboxylic acid, 5'-methyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.