TCA ammonium salt
TL;DR: TCA ammonium salt (CAS 7646-88-0) is a chemical compound with molecular formula C2H4Cl3NO2 and molecular weight 178.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 2,2,2-trichloroacetate
Also Known As: TCA-ammonium, AMMONIUM TRICHLOROACETATE, Caswell No. 049, TCA-ammonium [ISO], TCA ammonium salt
| Molecular Formula | C2H4Cl3NO2 |
|---|---|
| Molecular Weight | 178.93 g/mol |
| LogP | 0.48 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.93076 |
| Heavy Atoms | 8 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 7646-88-0 |
|---|---|
| SMILES | C(=O)(C(Cl)(Cl)Cl)[O-].[NH4+] |
| InChIKey | MHMUIIBVMBOAON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
TCA ammonium salt (CAS 7646-88-0), with molecular formula C2H4Cl3NO2 and molecular weight 178.93 g/mol. IUPAC: azanium 2,2,2-trichloroacetate.
Chemical Property Profile of TCA ammonium salt
Property Insights of TCA ammonium salt
The XLogP value of 0.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TCA ammonium salt. With a topological polar surface area (TPSA) of 41.1 Ų, TCA ammonium salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TCA ammonium salt has 1 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 TCA ammonium salt?
The CAS number of TCA ammonium salt is 7646-88-0.
What is the molecular formula of TCA ammonium salt?
The molecular formula of TCA ammonium salt is C2H4Cl3NO2.
What is the molecular weight of TCA ammonium salt?
The molecular weight of TCA ammonium salt is 178.93 g/mol.
Where can I buy TCA ammonium salt?
You can request a quote for TCA ammonium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TCA ammonium salt?
Yes, KEHONG BIO provides custom synthesis services for TCA ammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.