氯菊酯
TL;DR: 氯菊酯 (CAS 52645-53-1) is a chemical compound with molecular formula C21H20Cl2O3 and molecular weight 390.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯菊酯
(3-phenoxyphenyl)methyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Also Known As: Permethrin, Transpermethrin, Ambush, Pounce, Permethrine
| Molecular Formula | C21H20Cl2O3 |
|---|---|
| Molecular Weight | 390.08 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.07895 |
| Heavy Atoms | 26 |
| Complexity | 521.0 |
| Melting Point | 34 |
| Boiling Point | 220 |
| Density | 1.19 - 1.27 at 20 °C |
| Solubility | 0.006 |
| Vapor Pressure | 0.00000002 [mmHg] |
Chemical Identifiers
| CAS Number | 52645-53-1 |
|---|---|
| SMILES | CC1(C(C1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C |
| InChIKey | RLLPVAHGXHCWKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯菊酯 (CAS 52645-53-1), with molecular formula C21H20Cl2O3 and molecular weight 390.08 g/mol. IUPAC: (3-phenoxyphenyl)methyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate.
Chemical Property Profile of 氯菊酯
Property Insights of 氯菊酯
The XLogP value of 6.5 indicates that 氯菊酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 氯菊酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯菊酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 氯菊酯?
The CAS number of 氯菊酯 is 52645-53-1.
What is the molecular formula of 氯菊酯?
The molecular formula of 氯菊酯 is C21H20Cl2O3.
What is the molecular weight of 氯菊酯?
The molecular weight of 氯菊酯 is 390.08 g/mol.
Where can I buy 氯菊酯?
You can request a quote for 氯菊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯菊酯?
Yes, KEHONG BIO provides custom synthesis services for 氯菊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.