2-Bromophenylthioethanol
TL;DR: 2-Bromophenylthioethanol (CAS 117341-28-3) is a chemical compound with molecular formula C8H9BrOS and molecular weight 231.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromophenyl)sulfanylethanol
Also Known As: 2-Bromophenylthioethanol, 2-(2-bromophenyl)sulfanylethanol, 2-[(2-bromophenyl)sulfanyl]ethan-1-ol, 2-(2-bromophenylthio)ethan-1-ol, 2-((2-Bromophenyl)thio)ethan-1-ol
| Molecular Formula | C8H9BrOS |
|---|---|
| Molecular Weight | 231.96 g/mol |
| LogP | 2.5335 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.95575 |
| Heavy Atoms | 11 |
| Complexity | 227.08698 |
Chemical Identifiers
| CAS Number | 117341-28-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)SCCO)Br |
Product Overview
2-Bromophenylthioethanol (CAS 117341-28-3), with molecular formula C8H9BrOS and molecular weight 231.96 g/mol. IUPAC: 2-(2-bromophenyl)sulfanylethanol.
Chemical Property Profile of 2-Bromophenylthioethanol
Property Insights of 2-Bromophenylthioethanol
The XLogP value of 2.5335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromophenylthioethanol. With a topological polar surface area (TPSA) of 20.23 Ų, 2-Bromophenylthioethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromophenylthioethanol 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 2-Bromophenylthioethanol?
The CAS number of 2-Bromophenylthioethanol is 117341-28-3.
What is the molecular formula of 2-Bromophenylthioethanol?
The molecular formula of 2-Bromophenylthioethanol is C8H9BrOS.
What is the molecular weight of 2-Bromophenylthioethanol?
The molecular weight of 2-Bromophenylthioethanol is 231.96 g/mol.
Where can I buy 2-Bromophenylthioethanol?
You can request a quote for 2-Bromophenylthioethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromophenylthioethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromophenylthioethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.