Phenol, 5-bromo-2-mercapto-
TL;DR: Phenol, 5-bromo-2-mercapto- (CAS 127692-20-0) is a chemical compound with molecular formula C6H5BrOS and molecular weight 203.92445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-2-sulfanylphenol
Also Known As: 5-bromo-2-sulfanylphenol, Phenol,5-bromo-2-mercapto-, 4-Bromo-2-hydroxythiophenol, Phenol, 5-bromo-2-mercapto-, 5-BROMO-2-MERCAPTOPHENOL
Technical Specifications
| Molecular Formula | C6H5BrOS |
| Molecular Weight | 203.92445 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 21.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.92445 Da |
| Heavy Atoms | 9 |
| Complexity | 99.0 |
| SMILES | C1=CC(=C(C=C1Br)O)S |
| InChIKey | DWULLSCEGLJSIK-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, 5-bromo-2-mercapto-
Property Insights of Phenol, 5-bromo-2-mercapto-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 5-bromo-2-mercapto-. With a topological polar surface area (TPSA) of 21.2 Ų, Phenol, 5-bromo-2-mercapto- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 5-bromo-2-mercapto- 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
What is the CAS number of Phenol, 5-bromo-2-mercapto-?
The CAS number of Phenol, 5-bromo-2-mercapto- is 127692-20-0.
What is the molecular formula of Phenol, 5-bromo-2-mercapto-?
The molecular formula of Phenol, 5-bromo-2-mercapto- is C6H5BrOS.
What is the molecular weight of Phenol, 5-bromo-2-mercapto-?
The molecular weight of Phenol, 5-bromo-2-mercapto- is 203.92445 g/mol.
Where can I buy Phenol, 5-bromo-2-mercapto-?
You can request a quote for Phenol, 5-bromo-2-mercapto- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, 5-bromo-2-mercapto-?
Yes, CoreyChem provides custom synthesis services for Phenol, 5-bromo-2-mercapto- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.