Di-n-octyl disulfide
TL;DR: Di-n-octyl disulfide (CAS 822-27-5) is a chemical compound with molecular formula C16H34S2 and molecular weight 290.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(octyldisulfanyl)octane
Also Known As: Octyl disulfide, Dioctyl disulfide, Disulfide, dioctyl, Di-n-octyl disulfide, Dioctyl disulphide
| Molecular Formula | C16H34S2 |
|---|---|
| Molecular Weight | 290.21 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 290.2102 |
| Heavy Atoms | 18 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 822-27-5 |
|---|---|
| SMILES | CCCCCCCCSSCCCCCCCC |
| InChIKey | AROCLDYPZXMJPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-n-octyl disulfide (CAS 822-27-5), with molecular formula C16H34S2 and molecular weight 290.21 g/mol. IUPAC: 1-(octyldisulfanyl)octane.
Chemical Property Profile of Di-n-octyl disulfide
Property Insights of Di-n-octyl disulfide
The XLogP value of 7.7 indicates that Di-n-octyl disulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Di-n-octyl disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-n-octyl disulfide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Di-n-octyl disulfide?
The CAS number of Di-n-octyl disulfide is 822-27-5.
What is the molecular formula of Di-n-octyl disulfide?
The molecular formula of Di-n-octyl disulfide is C16H34S2.
What is the molecular weight of Di-n-octyl disulfide?
The molecular weight of Di-n-octyl disulfide is 290.21 g/mol.
Where can I buy Di-n-octyl disulfide?
You can request a quote for Di-n-octyl disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-n-octyl disulfide?
Yes, KEHONG BIO provides custom synthesis services for Di-n-octyl disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.