(2,4,5-Trichlorophenoxy)acetate
TL;DR: (2,4,5-Trichlorophenoxy)acetate (CAS 13560-99-1) is a chemical compound with molecular formula C8H4Cl3O3- and molecular weight 252.9226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4,5-trichlorophenoxy)acetate
Also Known As: Transamine, Brushtox, Dacamine, Tributon, Trinoxol
Technical Specifications
| Molecular Formula | C8H4Cl3O3- |
| Molecular Weight | 252.9226 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.9226 Da |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)[O-] |
| InChIKey | SMYMJHWAQXWPDB-UHFFFAOYSA-M |
Chemical Property Profile of (2,4,5-Trichlorophenoxy)acetate
Property Insights of (2,4,5-Trichlorophenoxy)acetate
The XLogP value of 4.0 indicates that (2,4,5-Trichlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, (2,4,5-Trichlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,4,5-Trichlorophenoxy)acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2,4,5-Trichlorophenoxy)acetate?
The CAS number of (2,4,5-Trichlorophenoxy)acetate is 13560-99-1.
What is the molecular formula of (2,4,5-Trichlorophenoxy)acetate?
The molecular formula of (2,4,5-Trichlorophenoxy)acetate is C8H4Cl3O3-.
What is the molecular weight of (2,4,5-Trichlorophenoxy)acetate?
The molecular weight of (2,4,5-Trichlorophenoxy)acetate is 252.9226 g/mol.
Where can I buy (2,4,5-Trichlorophenoxy)acetate?
You can request a quote for (2,4,5-Trichlorophenoxy)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2,4,5-Trichlorophenoxy)acetate?
Yes, CoreyChem provides custom synthesis services for (2,4,5-Trichlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.