Methyl 8-(2-furyl)octanoate
TL;DR: Methyl 8-(2-furyl)octanoate (CAS 38199-50-7) is a chemical compound with molecular formula C13H20O3 and molecular weight 224.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-(furan-2-yl)octanoate
Also Known As: Methyl 8-(2-furyl)octanoate, methyl 8-(furan-2-yl)octanoate, Methyl-8-(2-furyloctanoat), methyl 8-(2-furyl)-octanoate, 2-Furanoctanoic acid, methyl ester
| Molecular Formula | C13H20O3 |
|---|---|
| Molecular Weight | 224.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 224.14125 |
| Heavy Atoms | 16 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 38199-50-7 |
|---|---|
| SMILES | COC(=O)CCCCCCCC1=CC=CO1 |
| InChIKey | BEDHFJANVUDDFI-UHFFFAOYSA-N |
Product Overview
Methyl 8-(2-furyl)octanoate (CAS 38199-50-7), with molecular formula C13H20O3 and molecular weight 224.14 g/mol. IUPAC: methyl 8-(furan-2-yl)octanoate.
Chemical Property Profile of Methyl 8-(2-furyl)octanoate
Property Insights of Methyl 8-(2-furyl)octanoate
The XLogP value of 3.4 indicates that Methyl 8-(2-furyl)octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, Methyl 8-(2-furyl)octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-(2-furyl)octanoate has 0 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 Methyl 8-(2-furyl)octanoate?
The CAS number of Methyl 8-(2-furyl)octanoate is 38199-50-7.
What is the molecular formula of Methyl 8-(2-furyl)octanoate?
The molecular formula of Methyl 8-(2-furyl)octanoate is C13H20O3.
What is the molecular weight of Methyl 8-(2-furyl)octanoate?
The molecular weight of Methyl 8-(2-furyl)octanoate is 224.14 g/mol.
Where can I buy Methyl 8-(2-furyl)octanoate?
You can request a quote for Methyl 8-(2-furyl)octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-(2-furyl)octanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-(2-furyl)octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.