TCA-ethadyl
TL;DR: TCA-ethadyl (CAS 2514-53-6) is a chemical compound with molecular formula C6H4Cl6O4 and molecular weight 349.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2,2-trichloroacetyl)oxyethyl 2,2,2-trichloroacetate
Also Known As: TCA-ethadyl, Glytac, Ethylene trichloroacetate, TCA-ethadyl [ISO], Ethylene glycol bis(trichloroacetate)
| Molecular Formula | C6H4Cl6O4 |
|---|---|
| Molecular Weight | 349.82 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.82114 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 2514-53-6 |
|---|---|
| SMILES | C(COC(=O)C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl |
| InChIKey | SSDZRWBPFCFZGB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
TCA-ethadyl (CAS 2514-53-6), with molecular formula C6H4Cl6O4 and molecular weight 349.82 g/mol. IUPAC: 2-(2,2,2-trichloroacetyl)oxyethyl 2,2,2-trichloroacetate.
Chemical Property Profile of TCA-ethadyl
Property Insights of TCA-ethadyl
The XLogP value of 3.7 indicates that TCA-ethadyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, TCA-ethadyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TCA-ethadyl has 0 hydrogen bond donor(s) and 4 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 TCA-ethadyl?
The CAS number of TCA-ethadyl is 2514-53-6.
What is the molecular formula of TCA-ethadyl?
The molecular formula of TCA-ethadyl is C6H4Cl6O4.
What is the molecular weight of TCA-ethadyl?
The molecular weight of TCA-ethadyl is 349.82 g/mol.
Where can I buy TCA-ethadyl?
You can request a quote for TCA-ethadyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TCA-ethadyl?
Yes, KEHONG BIO provides custom synthesis services for TCA-ethadyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.