Acequinocyl
TL;DR: Acequinocyl (CAS 57960-19-7) is a chemical compound with molecular formula C24H32O4 and molecular weight 384.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-dodecyl-1,4-dioxonaphthalen-2-yl) acetate
Also Known As: Acequinocyl, Kanemite, Acequincyl, Shuttle, Acequinocyl [ISO]
| Molecular Formula | C24H32O4 |
|---|---|
| Molecular Weight | 384.23 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 384.23007 |
| Heavy Atoms | 28 |
| Complexity | 575.0 |
| Melting Point | 59.6 °C |
| Density | 1.15 at 25 °C |
| Solubility | In water, 6.69X10-3 mg/L at 20 °C |
| Vapor Pressure | 0.00000001 [mmHg] |
Chemical Identifiers
| CAS Number | 57960-19-7 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)OC(=O)C |
| InChIKey | QDRXWCAVUNHOGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acequinocyl (CAS 57960-19-7), with molecular formula C24H32O4 and molecular weight 384.23 g/mol. IUPAC: (3-dodecyl-1,4-dioxonaphthalen-2-yl) acetate.
Chemical Property Profile of Acequinocyl
Property Insights of Acequinocyl
The XLogP value of 7.6 indicates that Acequinocyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Acequinocyl. Following Lipinski's Rule of Five, Acequinocyl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acequinocyl?
The CAS number of Acequinocyl is 57960-19-7.
What is the molecular formula of Acequinocyl?
The molecular formula of Acequinocyl is C24H32O4.
What is the molecular weight of Acequinocyl?
The molecular weight of Acequinocyl is 384.23 g/mol.
Where can I buy Acequinocyl?
You can request a quote for Acequinocyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acequinocyl?
Yes, KEHONG BIO provides custom synthesis services for Acequinocyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.