2,4,6-三氯苯胺
TL;DR: 2,4,6-三氯苯胺 (CAS 634-93-5) is a chemical compound with molecular formula C6H4Cl3N and molecular weight 194.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-三氯苯胺
2,4,6-trichloroaniline
Also Known As: 2,4,6-TRICHLOROANILINE, s-Trichloroaniline, sym-Trichloroaniline, null, 2,4,6-Trichlorobenzenamine
| Molecular Formula | C6H4Cl3N |
|---|---|
| Molecular Weight | 194.94 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.94093 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
| Melting Point | 163 to 75.0 °C |
| Boiling Point | 262.2 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 70.7 °F (NTP, 1992) |
| Vapor Pressure | 1 mmHg at 134.0 °C ; 5 mmHg at 157.8 °C |
Chemical Identifiers
| CAS Number | 634-93-5 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)N)Cl)Cl |
| InChIKey | NATVSFWWYVJTAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-三氯苯胺 (CAS 634-93-5), with molecular formula C6H4Cl3N and molecular weight 194.94 g/mol. IUPAC: 2,4,6-trichloroaniline.
Chemical Property Profile of 2,4,6-三氯苯胺
Property Insights of 2,4,6-三氯苯胺
The XLogP value of 3.7 indicates that 2,4,6-三氯苯胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 2,4,6-三氯苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-三氯苯胺 has 1 hydrogen bond donor(s) and 1 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 2,4,6-三氯苯胺?
The CAS number of 2,4,6-三氯苯胺 is 634-93-5.
What is the molecular formula of 2,4,6-三氯苯胺?
The molecular formula of 2,4,6-三氯苯胺 is C6H4Cl3N.
What is the molecular weight of 2,4,6-三氯苯胺?
The molecular weight of 2,4,6-三氯苯胺 is 194.94 g/mol.
Where can I buy 2,4,6-三氯苯胺?
You can request a quote for 2,4,6-三氯苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-三氯苯胺?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-三氯苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.