1-(5-Chloro-2-methylsulfanylphenyl)ethanamine
TL;DR: 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine (CAS 897552-41-9) is a chemical compound with molecular formula C9H12ClNS and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-methylsulfanylphenyl)ethanamine
Also Known As: 1-(5-chloro-2-methylsulfanylphenyl)ethanamine, 1-(5-chloro-2-methylsulfanyl-phenyl)ethanamine, Benzenemethanamine, 5-chloro-alpha-methyl-2-(methylthio)-
| Molecular Formula | C9H12ClNS |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 3.0816 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.0379 |
| Heavy Atoms | 12 |
| Complexity | 273.23108 |
Chemical Identifiers
| CAS Number | 897552-41-9 |
|---|---|
| SMILES | CC(C1=C(C=CC(=C1)Cl)SC)N |
Product Overview
1-(5-Chloro-2-methylsulfanylphenyl)ethanamine (CAS 897552-41-9), with molecular formula C9H12ClNS and molecular weight 201.04 g/mol. IUPAC: 1-(5-chloro-2-methylsulfanylphenyl)ethanamine.
Chemical Property Profile of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine
Property Insights of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine
The XLogP value of 3.0816 indicates that 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine 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 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine?
The CAS number of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine is 897552-41-9.
What is the molecular formula of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine?
The molecular formula of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine is C9H12ClNS.
What is the molecular weight of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine?
The molecular weight of 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine is 201.04 g/mol.
Where can I buy 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine?
You can request a quote for 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-methylsulfanylphenyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.