氰氟草酯
TL;DR: 氰氟草酯 (CAS 122008-85-9) is a chemical compound with molecular formula C20H20FNO4 and molecular weight 357.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氰氟草酯
butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate
Also Known As: Cyhalofop-butyl, Clincher, Cyhalofop Butyl, Barnstorm, Cyhalofop
| Molecular Formula | C20H20FNO4 |
|---|---|
| Molecular Weight | 357.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 68.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 357.13763 |
| Heavy Atoms | 26 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 122008-85-9 |
|---|---|
| SMILES | CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F |
| InChIKey | TYIYMOAHACZAMQ-CQSZACIVSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氰氟草酯 (CAS 122008-85-9), with molecular formula C20H20FNO4 and molecular weight 357.14 g/mol. IUPAC: butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate.
Chemical Property Profile of 氰氟草酯
Property Insights of 氰氟草酯
The XLogP value of 4.8 indicates that 氰氟草酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 氰氟草酯. Following Lipinski's Rule of Five, 氰氟草酯 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 氰氟草酯?
The CAS number of 氰氟草酯 is 122008-85-9.
What is the molecular formula of 氰氟草酯?
The molecular formula of 氰氟草酯 is C20H20FNO4.
What is the molecular weight of 氰氟草酯?
The molecular weight of 氰氟草酯 is 357.14 g/mol.
Where can I buy 氰氟草酯?
You can request a quote for 氰氟草酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氰氟草酯?
Yes, KEHONG BIO provides custom synthesis services for 氰氟草酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.