2,4-Dichlorophenoxyacetic acid isooctyl ester
TL;DR: 2,4-Dichlorophenoxyacetic acid isooctyl ester (CAS 25168-26-7) is a chemical compound with molecular formula C16H22Cl2O3 and molecular weight 332.0946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methylheptyl 2-(2,4-dichlorophenoxy)acetate
Also Known As: 2,4-D ISOOCTYL ESTER, Silvapron D, Weedtrine-II, Agroxone 5, 2,4-D-isoctyl
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H22Cl2O3 |
| Molecular Weight | 332.0946 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 332.0946 Da |
| Heavy Atoms | 21 |
| Complexity | 297.0 |
| Vapor Pressure | 0.00000706 [mmHg] |
| SMILES | CC(C)CCCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | BBPLSOGERZQYQC-UHFFFAOYSA-N |
Chemical Property Profile of 2,4-Dichlorophenoxyacetic acid isooctyl ester
Property Insights of 2,4-Dichlorophenoxyacetic acid isooctyl ester
The XLogP value of 6.3 indicates that 2,4-Dichlorophenoxyacetic acid isooctyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2,4-Dichlorophenoxyacetic acid isooctyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichlorophenoxyacetic acid isooctyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,4-Dichlorophenoxyacetic acid isooctyl ester?
The CAS number of 2,4-Dichlorophenoxyacetic acid isooctyl ester is 25168-26-7.
What is the molecular formula of 2,4-Dichlorophenoxyacetic acid isooctyl ester?
The molecular formula of 2,4-Dichlorophenoxyacetic acid isooctyl ester is C16H22Cl2O3.
What is the molecular weight of 2,4-Dichlorophenoxyacetic acid isooctyl ester?
The molecular weight of 2,4-Dichlorophenoxyacetic acid isooctyl ester is 332.0946 g/mol.
Where can I buy 2,4-Dichlorophenoxyacetic acid isooctyl ester?
You can request a quote for 2,4-Dichlorophenoxyacetic acid isooctyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dichlorophenoxyacetic acid isooctyl ester?
Yes, CoreyChem provides custom synthesis services for 2,4-Dichlorophenoxyacetic acid isooctyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.