Fenoxaprop-ethyl
TL;DR: Fenoxaprop-ethyl (CAS 66441-23-4) is a chemical compound with molecular formula C18H16ClNO5 and molecular weight 361.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate
Also Known As: FENOXAPROP-ETHYL, Fenoxaprop ethyl, Acclaim, Furore, Depon
| Molecular Formula | C18H16ClNO5 |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 361.0717 |
| Heavy Atoms | 25 |
| Complexity | 443.0 |
| Melting Point | 84-85 °C |
| Boiling Point | 200 °C @ 100 pa |
| Solubility | Solubility @ 20 °C: >0.5% in hexane; >1% in cyclohexane, ethanol, 1-octanol; >20%in ethyl acetate; >30% in toluene; >50% in acetone; solubility in water @ 25 °C: 0.9 mg/l |
| Vapor Pressure | 0.00000001 [mmHg] |
Chemical Identifiers
| CAS Number | 66441-23-4 |
|---|---|
| SMILES | CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl |
| InChIKey | PQKBPHSEKWERTG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fenoxaprop-ethyl (CAS 66441-23-4), with molecular formula C18H16ClNO5 and molecular weight 361.07 g/mol. IUPAC: ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate.
Chemical Property Profile of Fenoxaprop-ethyl
Property Insights of Fenoxaprop-ethyl
The XLogP value of 4.1 indicates that Fenoxaprop-ethyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Fenoxaprop-ethyl. Following Lipinski's Rule of Five, Fenoxaprop-ethyl has 0 hydrogen bond donor(s) and 6 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 Fenoxaprop-ethyl?
The CAS number of Fenoxaprop-ethyl is 66441-23-4.
What is the molecular formula of Fenoxaprop-ethyl?
The molecular formula of Fenoxaprop-ethyl is C18H16ClNO5.
What is the molecular weight of Fenoxaprop-ethyl?
The molecular weight of Fenoxaprop-ethyl is 361.07 g/mol.
Where can I buy Fenoxaprop-ethyl?
You can request a quote for Fenoxaprop-ethyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fenoxaprop-ethyl?
Yes, KEHONG BIO provides custom synthesis services for Fenoxaprop-ethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.