3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid
TL;DR: 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid (CAS 86879-39-2) is a chemical compound with molecular formula C12H16O5 and molecular weight 240.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-carboxyethyl)-4-methyl-5-propylfuran-3-carboxylic acid
Also Known As: CMPF, Cmpfpa, furanic acid, propylfuranoic acid, CMPF cpd
| Molecular Formula | C12H16O5 |
|---|---|
| Molecular Weight | 240.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.09978 |
| Heavy Atoms | 17 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 86879-39-2 |
|---|---|
| SMILES | CCCC1=C(C(=C(O1)CCC(=O)O)C(=O)O)C |
| InChIKey | WMCQWXZMVIETAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid (CAS 86879-39-2), with molecular formula C12H16O5 and molecular weight 240.10 g/mol. IUPAC: 2-(2-carboxyethyl)-4-methyl-5-propylfuran-3-carboxylic acid.
Chemical Property Profile of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid
Property Insights of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid. Following Lipinski's Rule of Five, 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid has 2 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 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid?
The CAS number of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid is 86879-39-2.
What is the molecular formula of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid?
The molecular formula of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid is C12H16O5.
What is the molecular weight of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid?
The molecular weight of 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid is 240.10 g/mol.
Where can I buy 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid?
You can request a quote for 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxy-4-Methyl-5-Propyl-2-Furanpropanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.