2,4,5-Trichlorophenoxyacetyl chloride
TL;DR: 2,4,5-Trichlorophenoxyacetyl chloride (CAS 777-08-2) is a chemical compound with molecular formula C8H4Cl4O2 and molecular weight 271.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,5-trichlorophenoxy)acetyl chloride
Also Known As: 2,4,5-trichlorophenoxyacetyl chloride, 2-(2,4,5-trichlorophenoxy)acetyl chloride, (2,4,5-trichlorophenoxy)acetyl chloride, Acetyl chloride, 2-(2,4,5-trichlorophenoxy)-, RefChem:245556
| Molecular Formula | C8H4Cl4O2 |
|---|---|
| Molecular Weight | 271.90 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.89655 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 777-08-2 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)Cl |
| InChIKey | AZFAIOQVEYTPKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,5-Trichlorophenoxyacetyl chloride (CAS 777-08-2), with molecular formula C8H4Cl4O2 and molecular weight 271.90 g/mol. IUPAC: 2-(2,4,5-trichlorophenoxy)acetyl chloride.
Chemical Property Profile of 2,4,5-Trichlorophenoxyacetyl chloride
Property Insights of 2,4,5-Trichlorophenoxyacetyl chloride
The XLogP value of 4.3 indicates that 2,4,5-Trichlorophenoxyacetyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,4,5-Trichlorophenoxyacetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trichlorophenoxyacetyl chloride 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 2,4,5-Trichlorophenoxyacetyl chloride?
The CAS number of 2,4,5-Trichlorophenoxyacetyl chloride is 777-08-2.
What is the molecular formula of 2,4,5-Trichlorophenoxyacetyl chloride?
The molecular formula of 2,4,5-Trichlorophenoxyacetyl chloride is C8H4Cl4O2.
What is the molecular weight of 2,4,5-Trichlorophenoxyacetyl chloride?
The molecular weight of 2,4,5-Trichlorophenoxyacetyl chloride is 271.90 g/mol.
Where can I buy 2,4,5-Trichlorophenoxyacetyl chloride?
You can request a quote for 2,4,5-Trichlorophenoxyacetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,5-Trichlorophenoxyacetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2,4,5-Trichlorophenoxyacetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.