苄呋菊酯
TL;DR: 苄呋菊酯 (CAS 10453-86-8) is a chemical compound with molecular formula C22H26O3 and molecular weight 338.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苄呋菊酯
(5-benzylfuran-3-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: resmethrin, Benzofuroline, Chrysron, Synthrin, Chryson
| Molecular Formula | C22H26O3 |
|---|---|
| Molecular Weight | 338.19 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 338.1882 |
| Heavy Atoms | 25 |
| Complexity | 497.0 |
| Melting Point | 56.5 °C (pure (1-RS)-trans isomer) |
| Boiling Point | Decomposes at >180 °C |
| Density | 0.958-0.968 at 20 °C |
| Solubility | Very sol in xylene and aromatic petroleum hydrocarbons; solubility in kerosene 10% |
| Vapor Pressure | 0.00000001 [mmHg] |
| Refractive Index | Refractive index at 20 °C= 1.5287 |
Chemical Identifiers
| CAS Number | 10453-86-8 |
|---|---|
| SMILES | CC(=CC1C(C1(C)C)C(=O)OCC2=COC(=C2)CC3=CC=CC=C3)C |
| InChIKey | VEMKTZHHVJILDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苄呋菊酯 (CAS 10453-86-8), with molecular formula C22H26O3 and molecular weight 338.19 g/mol. IUPAC: (5-benzylfuran-3-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of 苄呋菊酯
Property Insights of 苄呋菊酯
The XLogP value of 6.1 indicates that 苄呋菊酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, 苄呋菊酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苄呋菊酯 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 苄呋菊酯?
The CAS number of 苄呋菊酯 is 10453-86-8.
What is the molecular formula of 苄呋菊酯?
The molecular formula of 苄呋菊酯 is C22H26O3.
What is the molecular weight of 苄呋菊酯?
The molecular weight of 苄呋菊酯 is 338.19 g/mol.
Where can I buy 苄呋菊酯?
You can request a quote for 苄呋菊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苄呋菊酯?
Yes, KEHONG BIO provides custom synthesis services for 苄呋菊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.