4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide
TL;DR: 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide (CAS 58568-60-8) is a chemical compound with molecular formula C12H23BrO3S and molecular weight 326.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-5-nonyloxathiolane 2,2-dioxide
Also Known As: 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide, 4-bromo-5-nonyloxathiolane 2,2-dioxide, 1,2-Oxathiolane, 4-bromo-5-nonyl-, 2,2-dioxide, 4-Bromo-5-nonyl-1,2lambda~6~-oxathiolane-2,2-dione
| Molecular Formula | C12H23BrO3S |
|---|---|
| Molecular Weight | 326.06 g/mol |
| LogP | 3.6192 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 326.0551 |
| Heavy Atoms | 17 |
| Complexity | 302.8726 |
Chemical Identifiers
| CAS Number | 58568-60-8 |
|---|---|
| SMILES | CCCCCCCCCC1C(CS(=O)(=O)O1)Br |
Product Overview
4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide (CAS 58568-60-8), with molecular formula C12H23BrO3S and molecular weight 326.06 g/mol. IUPAC: 4-bromo-5-nonyloxathiolane 2,2-dioxide.
Chemical Property Profile of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide
Property Insights of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide
The XLogP value of 3.6192 indicates that 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide has 0 hydrogen bond donor(s) and 3 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 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide?
The CAS number of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide is 58568-60-8.
What is the molecular formula of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide?
The molecular formula of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide is C12H23BrO3S.
What is the molecular weight of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide?
The molecular weight of 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide is 326.06 g/mol.
Where can I buy 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide?
You can request a quote for 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-5-nonyl-1,2-oxathiolane 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.