Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)
TL;DR: Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) (CAS 13663-07-5) is a chemical compound with molecular formula C12H19Cl2NS and molecular weight 279.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfanylethyl-diethylazanium chloride
Also Known As: CPTA, CPTA (plant growth regulator), USAF A-12621, 2-(4-Chlorophenylthio)triethylamine hydrochloride, Chlorophenylthiotriethylamine hydrochloride
| Molecular Formula | C12H19Cl2NS |
|---|---|
| Molecular Weight | 279.06 g/mol |
| LogP | -0.64 |
| Topological Polar Surface Area | 29.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.06152 |
| Heavy Atoms | 16 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 13663-07-5 |
|---|---|
| SMILES | CC[NH+](CC)CCSC1=CC=C(C=C1)Cl.[Cl-] |
| InChIKey | RPNMGUBLKCLAEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) (CAS 13663-07-5), with molecular formula C12H19Cl2NS and molecular weight 279.06 g/mol. IUPAC: 2-(4-chlorophenyl)sulfanylethyl-diethylazanium chloride.
Chemical Property Profile of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)
Property Insights of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)
The XLogP value of -0.64 indicates that Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.7 Ų, Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) 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 Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)?
The CAS number of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) is 13663-07-5.
What is the molecular formula of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)?
The molecular formula of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) is C12H19Cl2NS.
What is the molecular weight of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)?
The molecular weight of Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) is 279.06 g/mol.
Where can I buy Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)?
You can request a quote for Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethanamine, 2-((4-chlorophenyl)thio)-N,N-diethyl-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.