Phenol, 2,4-dichloro-, trichloroacetate
TL;DR: Phenol, 2,4-dichloro-, trichloroacetate (CAS 35501-23-6) is a chemical compound with molecular formula C8H3Cl5O2 and molecular weight 305.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichlorophenyl) 2,2,2-trichloroacetate
Also Known As: 2,4-Dichlorophenyl trichloroacetate, 2,4-Dichlorophenol trichloroacetate, Phenol, 2,4-dichloro-, trichloroacetate, 2.4-Dichlor-1-trichloracetoxy-benzol, Acetic acid, trichloro-, 2,4-dichlorophenyl ester
| Molecular Formula | C8H3Cl5O2 |
|---|---|
| Molecular Weight | 305.86 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.85757 |
| Heavy Atoms | 15 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 35501-23-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)OC(=O)C(Cl)(Cl)Cl |
| InChIKey | VNVHPDIADHUZNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2,4-dichloro-, trichloroacetate (CAS 35501-23-6), with molecular formula C8H3Cl5O2 and molecular weight 305.86 g/mol. IUPAC: (2,4-dichlorophenyl) 2,2,2-trichloroacetate.
Chemical Property Profile of Phenol, 2,4-dichloro-, trichloroacetate
Property Insights of Phenol, 2,4-dichloro-, trichloroacetate
The XLogP value of 4.5 indicates that Phenol, 2,4-dichloro-, trichloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Phenol, 2,4-dichloro-, trichloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,4-dichloro-, trichloroacetate 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 Phenol, 2,4-dichloro-, trichloroacetate?
The CAS number of Phenol, 2,4-dichloro-, trichloroacetate is 35501-23-6.
What is the molecular formula of Phenol, 2,4-dichloro-, trichloroacetate?
The molecular formula of Phenol, 2,4-dichloro-, trichloroacetate is C8H3Cl5O2.
What is the molecular weight of Phenol, 2,4-dichloro-, trichloroacetate?
The molecular weight of Phenol, 2,4-dichloro-, trichloroacetate is 305.86 g/mol.
Where can I buy Phenol, 2,4-dichloro-, trichloroacetate?
You can request a quote for Phenol, 2,4-dichloro-, trichloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,4-dichloro-, trichloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,4-dichloro-, trichloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.