Furethrin
TL;DR: Furethrin (CAS 17080-02-3) is a chemical compound with molecular formula C21H26O4 and molecular weight 342.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(furan-2-ylmethyl)-2-methyl-4-oxocyclopent-2-en-1-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: FURETHRIN, Caswell No. 465F, EPA Pesticide Chemical Code 466300, FURETHRIN, (+-)-, FURETHRIN, (+/-)-
| Molecular Formula | C21H26O4 |
|---|---|
| Molecular Weight | 342.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.1831 |
| Heavy Atoms | 25 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 17080-02-3 |
|---|---|
| SMILES | CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC3=CC=CO3 |
| InChIKey | BEYOLLQLGMGJDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Furethrin (CAS 17080-02-3), with molecular formula C21H26O4 and molecular weight 342.18 g/mol. IUPAC: [3-(furan-2-ylmethyl)-2-methyl-4-oxocyclopent-2-en-1-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of Furethrin
Property Insights of Furethrin
The XLogP value of 4.7 indicates that Furethrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.5 Ų, Furethrin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furethrin 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 Furethrin?
The CAS number of Furethrin is 17080-02-3.
What is the molecular formula of Furethrin?
The molecular formula of Furethrin is C21H26O4.
What is the molecular weight of Furethrin?
The molecular weight of Furethrin is 342.18 g/mol.
Where can I buy Furethrin?
You can request a quote for Furethrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furethrin?
Yes, KEHONG BIO provides custom synthesis services for Furethrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.