2,4,5-T-pentyl
TL;DR: 2,4,5-T-pentyl (CAS 120-39-8) is a chemical compound with molecular formula C13H15Cl3O3 and molecular weight 324.00867 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentyl 2-(2,4,5-trichlorophenoxy)acetate
Also Known As: Trifenox, Tormona 80, Trifenox 80, 2,4,5-T-pentyl, 2,4,5-T amyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H15Cl3O3 |
| Molecular Weight | 324.00867 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 324.00867 Da |
| Heavy Atoms | 19 |
| Complexity | 276.0 |
| SMILES | CCCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | BNANYJKQNHOIPC-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,5-T-pentyl
Property Insights of 2,4,5-T-pentyl
The XLogP value of 5.4 indicates that 2,4,5-T-pentyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2,4,5-T-pentyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-T-pentyl 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 2,4,5-T-pentyl?
The CAS number of 2,4,5-T-pentyl is 120-39-8.
What is the molecular formula of 2,4,5-T-pentyl?
The molecular formula of 2,4,5-T-pentyl is C13H15Cl3O3.
What is the molecular weight of 2,4,5-T-pentyl?
The molecular weight of 2,4,5-T-pentyl is 324.00867 g/mol.
Where can I buy 2,4,5-T-pentyl?
You can request a quote for 2,4,5-T-pentyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,5-T-pentyl?
Yes, CoreyChem provides custom synthesis services for 2,4,5-T-pentyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.