2-(3-溴苯基)-1,3-二硫杂环戊烷
TL;DR: 2-(3-溴苯基)-1,3-二硫杂环戊烷 (CAS 82436-20-2) is a chemical compound with molecular formula C9H9BrS2 and molecular weight 259.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-溴苯基)-1,3-二硫杂环戊烷
2-(3-bromophenyl)-1,3-dithiolane
Also Known As: 2-(3-bromophenyl)-1,3-dithiolane, 2-(m-Bromophenyl)-1,3-dithiolane, 1,3-DITHIOLANE, 2-(m-BROMOPHENYL)-, 1,3-DITHIOLANE,2- -, RefChem:1061057
| Molecular Formula | C9H9BrS2 |
|---|---|
| Molecular Weight | 259.93 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.93292 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 82436-20-2 |
|---|---|
| SMILES | C1CSC(S1)C2=CC(=CC=C2)Br |
| InChIKey | JHRNZQWXJTUNHH-UHFFFAOYSA-N |
Product Overview
2-(3-溴苯基)-1,3-二硫杂环戊烷 (CAS 82436-20-2), with molecular formula C9H9BrS2 and molecular weight 259.93 g/mol. IUPAC: 2-(3-bromophenyl)-1,3-dithiolane.
Chemical Property Profile of 2-(3-溴苯基)-1,3-二硫杂环戊烷
Property Insights of 2-(3-溴苯基)-1,3-二硫杂环戊烷
The XLogP value of 3.6 indicates that 2-(3-溴苯基)-1,3-二硫杂环戊烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 2-(3-溴苯基)-1,3-二硫杂环戊烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-溴苯基)-1,3-二硫杂环戊烷 has 0 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-(3-溴苯基)-1,3-二硫杂环戊烷?
The CAS number of 2-(3-溴苯基)-1,3-二硫杂环戊烷 is 82436-20-2.
What is the molecular formula of 2-(3-溴苯基)-1,3-二硫杂环戊烷?
The molecular formula of 2-(3-溴苯基)-1,3-二硫杂环戊烷 is C9H9BrS2.
What is the molecular weight of 2-(3-溴苯基)-1,3-二硫杂环戊烷?
The molecular weight of 2-(3-溴苯基)-1,3-二硫杂环戊烷 is 259.93 g/mol.
Where can I buy 2-(3-溴苯基)-1,3-二硫杂环戊烷?
You can request a quote for 2-(3-溴苯基)-1,3-二硫杂环戊烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-溴苯基)-1,3-二硫杂环戊烷?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-溴苯基)-1,3-二硫杂环戊烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.