氟虫脲
TL;DR: 氟虫脲 (CAS 101463-69-8) is a chemical compound with molecular formula C21H11ClF6N2O3 and molecular weight 488.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氟虫脲
N-[[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl]carbamoyl]-2,6-difluorobenzamide
Also Known As: Flufenoxuron, Cascade, Flufenoxuron [ISO], Flurox, Cascade[Cascade]
| Molecular Formula | C21H11ClF6N2O3 |
|---|---|
| Molecular Weight | 488.04 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.03622 |
| Heavy Atoms | 33 |
| Complexity | 689.0 |
| Melting Point | 169-172 °C (decomposes) |
| Density | Relative density = 1.57 g/mL |
| Solubility | In xylene 6, n-hexane 0.11, cyclohexane 95, dichloromethane 18.8, methanol 3.5, acetone 73.8 (all in g/L, 25 °C) |
| Vapor Pressure | 6.52X10-9 mPa /SRC: 4.89X10-14 mm Hg/ at 20 °C |
Chemical Identifiers
| CAS Number | 101463-69-8 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=C(C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)F)F |
| InChIKey | RYLHNOVXKPXDIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氟虫脲 (CAS 101463-69-8), with molecular formula C21H11ClF6N2O3 and molecular weight 488.04 g/mol. IUPAC: N-[[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl]carbamoyl]-2,6-difluorobenzamide.
Chemical Property Profile of 氟虫脲
Property Insights of 氟虫脲
The XLogP value of 6.3 indicates that 氟虫脲 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 氟虫脲. Following Lipinski's Rule of Five, 氟虫脲 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 氟虫脲?
The CAS number of 氟虫脲 is 101463-69-8.
What is the molecular formula of 氟虫脲?
The molecular formula of 氟虫脲 is C21H11ClF6N2O3.
What is the molecular weight of 氟虫脲?
The molecular weight of 氟虫脲 is 488.04 g/mol.
Where can I buy 氟虫脲?
You can request a quote for 氟虫脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氟虫脲?
Yes, KEHONG BIO provides custom synthesis services for 氟虫脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.