Phenol, o-mercapto-(6CI,7CI,8CI)
TL;DR: Phenol, o-mercapto-(6CI,7CI,8CI) (CAS 1121-24-0) is a chemical compound with molecular formula C6H6OS and molecular weight 126.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-sulfanylphenol
Also Known As: 2-Mercaptophenol, 2-Hydroxythiophenol, 2-Sulfanylphenol, o-Mercaptophenol, Phenol, 2-mercapto-
| Molecular Formula | C6H6OS |
|---|---|
| Molecular Weight | 126.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 21.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.01394 |
| Heavy Atoms | 8 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 1121-24-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)O)S |
| InChIKey | VMKYTRPNOVFCGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, o-mercapto-(6CI,7CI,8CI) (CAS 1121-24-0), with molecular formula C6H6OS and molecular weight 126.01 g/mol. IUPAC: 2-sulfanylphenol.
Chemical Property Profile of Phenol, o-mercapto-(6CI,7CI,8CI)
Property Insights of Phenol, o-mercapto-(6CI,7CI,8CI)
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, o-mercapto-(6CI,7CI,8CI). With a topological polar surface area (TPSA) of 21.2 Ų, Phenol, o-mercapto-(6CI,7CI,8CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, o-mercapto-(6CI,7CI,8CI) has 2 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 Phenol, o-mercapto-(6CI,7CI,8CI)?
The CAS number of Phenol, o-mercapto-(6CI,7CI,8CI) is 1121-24-0.
What is the molecular formula of Phenol, o-mercapto-(6CI,7CI,8CI)?
The molecular formula of Phenol, o-mercapto-(6CI,7CI,8CI) is C6H6OS.
What is the molecular weight of Phenol, o-mercapto-(6CI,7CI,8CI)?
The molecular weight of Phenol, o-mercapto-(6CI,7CI,8CI) is 126.01 g/mol.
Where can I buy Phenol, o-mercapto-(6CI,7CI,8CI)?
You can request a quote for Phenol, o-mercapto-(6CI,7CI,8CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, o-mercapto-(6CI,7CI,8CI)?
Yes, KEHONG BIO provides custom synthesis services for Phenol, o-mercapto-(6CI,7CI,8CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.