2-(4-Chlorophenylthio)triethylamine
TL;DR: 2-(4-Chlorophenylthio)triethylamine (CAS 14214-33-6) is a chemical compound with molecular formula C12H18ClNS and molecular weight 243.08485 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chlorophenyl)sulfanyl-N,N-diethylethanamine
Also Known As: 2-(4-Chlorophenylthio)triethylamine, CPTA, Amchem 72-A42, CPTA (plant growth regulator), USAF A-12621
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H18ClNS |
| Molecular Weight | 243.08485 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 243.08485 Da |
| Heavy Atoms | 15 |
| Complexity | 154.0 |
| SMILES | CCN(CC)CCSC1=CC=C(C=C1)Cl |
| InChIKey | XGTCHKSZCHPKBU-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Chlorophenylthio)triethylamine
Property Insights of 2-(4-Chlorophenylthio)triethylamine
The XLogP value of 3.8 indicates that 2-(4-Chlorophenylthio)triethylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, 2-(4-Chlorophenylthio)triethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenylthio)triethylamine 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
What is the CAS number of 2-(4-Chlorophenylthio)triethylamine?
The CAS number of 2-(4-Chlorophenylthio)triethylamine is 14214-33-6.
What is the molecular formula of 2-(4-Chlorophenylthio)triethylamine?
The molecular formula of 2-(4-Chlorophenylthio)triethylamine is C12H18ClNS.
What is the molecular weight of 2-(4-Chlorophenylthio)triethylamine?
The molecular weight of 2-(4-Chlorophenylthio)triethylamine is 243.08485 g/mol.
Where can I buy 2-(4-Chlorophenylthio)triethylamine?
You can request a quote for 2-(4-Chlorophenylthio)triethylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Chlorophenylthio)triethylamine?
Yes, CoreyChem provides custom synthesis services for 2-(4-Chlorophenylthio)triethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.