Imazalil
TL;DR: Imazalil (CAS 35554-44-0) is a chemical compound with molecular formula C14H14Cl2N2O and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole
Also Known As: IMAZALIL, Enilconazole, Fungaflor, Deccozil, Imaverol
| Molecular Formula | C14H14Cl2N2O |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.0483 |
| Heavy Atoms | 19 |
| Complexity | 291.0 |
| Melting Point | 52.7 °C |
| Boiling Point | 347 °C |
| Density | 1.348 g/ml at 26 °C |
| Solubility | In acetone, dichloromethane, ethanol, methanol, isopropanol, xylene, toluene, benzene > 500g/L at 20 °C. In hexane 19 g/L at 20 °C. Also soluble in heptane and petroleum ether. |
| Flash Point | 192 °C |
| Vapor Pressure | 0.00000119 [mmHg] |
| Refractive Index | = 1.5643 at 20 °C |
Chemical Identifiers
| CAS Number | 35554-44-0 |
|---|---|
| SMILES | C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | PZBPKYOVPCNPJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Imazalil (CAS 35554-44-0), with molecular formula C14H14Cl2N2O and molecular weight 296.05 g/mol. IUPAC: 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole.
Chemical Property Profile of Imazalil
Property Insights of Imazalil
The XLogP value of 3.8 indicates that Imazalil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.1 Ų, Imazalil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imazalil has 0 hydrogen bond donor(s) and 2 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 Imazalil?
The CAS number of Imazalil is 35554-44-0.
What is the molecular formula of Imazalil?
The molecular formula of Imazalil is C14H14Cl2N2O.
What is the molecular weight of Imazalil?
The molecular weight of Imazalil is 296.05 g/mol.
Where can I buy Imazalil?
You can request a quote for Imazalil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imazalil?
Yes, KEHONG BIO provides custom synthesis services for Imazalil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.