2-Chloro-6-methylthiophenol
TL;DR: 2-Chloro-6-methylthiophenol (CAS 18858-05-4) is a chemical compound with molecular formula C7H7ClS and molecular weight 158.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-methylbenzenethiol
Also Known As: 2-Chloro-6-methylthiophenol, 2-chloro-6-methylbenzenethiol, 2-chloro-6-methylbenzene-1-thiol, Benzenethiol, 2-chloro-6-methyl-, methyl thiyl chlorobenzene
| Molecular Formula | C7H7ClS |
|---|---|
| Molecular Weight | 158.00 g/mol |
| LogP | 2.93712 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.9957 |
| Heavy Atoms | 9 |
| Complexity | 199.90617 |
Chemical Identifiers
| CAS Number | 18858-05-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)S |
Product Overview
2-Chloro-6-methylthiophenol (CAS 18858-05-4), with molecular formula C7H7ClS and molecular weight 158.00 g/mol. IUPAC: 2-chloro-6-methylbenzenethiol.
Chemical Property Profile of 2-Chloro-6-methylthiophenol
Property Insights of 2-Chloro-6-methylthiophenol
The XLogP value of 2.93712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-6-methylthiophenol. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Chloro-6-methylthiophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-6-methylthiophenol 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-Chloro-6-methylthiophenol?
The CAS number of 2-Chloro-6-methylthiophenol is 18858-05-4.
What is the molecular formula of 2-Chloro-6-methylthiophenol?
The molecular formula of 2-Chloro-6-methylthiophenol is C7H7ClS.
What is the molecular weight of 2-Chloro-6-methylthiophenol?
The molecular weight of 2-Chloro-6-methylthiophenol is 158.00 g/mol.
Where can I buy 2-Chloro-6-methylthiophenol?
You can request a quote for 2-Chloro-6-methylthiophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6-methylthiophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6-methylthiophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.