Dodecoxymethanedithioic acid
TL;DR: Dodecoxymethanedithioic acid (CAS 6791-06-6) is a chemical compound with molecular formula C13H26OS2 and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecoxymethanedithioic acid
Also Known As: dodecoxymethanedithioic acid, dodecyl sulfanylmethanethioate, Carbonodithioic acid, O-dodecyl ester, Dithiocarbonic acid O-dodecyl ester, O-Dodecyl hydrogen carbonodithioate
| Molecular Formula | C13H26OS2 |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 262.14252 |
| Heavy Atoms | 16 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 6791-06-6 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=S)S |
| InChIKey | GYRLIFXJBOSGLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dodecoxymethanedithioic acid (CAS 6791-06-6), with molecular formula C13H26OS2 and molecular weight 262.14 g/mol. IUPAC: dodecoxymethanedithioic acid.
Chemical Property Profile of Dodecoxymethanedithioic acid
Property Insights of Dodecoxymethanedithioic acid
The XLogP value of 6.8 indicates that Dodecoxymethanedithioic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.3 Ų, Dodecoxymethanedithioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecoxymethanedithioic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecoxymethanedithioic acid?
The CAS number of Dodecoxymethanedithioic acid is 6791-06-6.
What is the molecular formula of Dodecoxymethanedithioic acid?
The molecular formula of Dodecoxymethanedithioic acid is C13H26OS2.
What is the molecular weight of Dodecoxymethanedithioic acid?
The molecular weight of Dodecoxymethanedithioic acid is 262.14 g/mol.
Where can I buy Dodecoxymethanedithioic acid?
You can request a quote for Dodecoxymethanedithioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecoxymethanedithioic acid?
Yes, KEHONG BIO provides custom synthesis services for Dodecoxymethanedithioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.