Ditridecyl sulfosuccinate
TL;DR: Ditridecyl sulfosuccinate (CAS 18271-58-4) is a chemical compound with molecular formula C30H58O7S and molecular weight 562.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxo-1,4-di(tridecoxy)butane-2-sulfonic acid
Also Known As: Ditridecyl sulfosuccinate, Aerosol TR, Monawet MT, Aerosol TR-70, bistridecyl sulfosuccinate
| Molecular Formula | C30H58O7S |
|---|---|
| Molecular Weight | 562.39 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 30 |
| Exact Mass | 562.3903 |
| Heavy Atoms | 38 |
| Complexity | 658.0 |
Chemical Identifiers
| CAS Number | 18271-58-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCCCCCC)S(=O)(=O)O |
| InChIKey | ICAXUQIEOXHXKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ditridecyl sulfosuccinate (CAS 18271-58-4), with molecular formula C30H58O7S and molecular weight 562.39 g/mol. IUPAC: 1,4-dioxo-1,4-di(tridecoxy)butane-2-sulfonic acid.
Chemical Property Profile of Ditridecyl sulfosuccinate
Property Insights of Ditridecyl sulfosuccinate
The XLogP value of 11.1 indicates that Ditridecyl sulfosuccinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ditridecyl sulfosuccinate. Following Lipinski's Rule of Five, Ditridecyl sulfosuccinate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ditridecyl sulfosuccinate?
The CAS number of Ditridecyl sulfosuccinate is 18271-58-4.
What is the molecular formula of Ditridecyl sulfosuccinate?
The molecular formula of Ditridecyl sulfosuccinate is C30H58O7S.
What is the molecular weight of Ditridecyl sulfosuccinate?
The molecular weight of Ditridecyl sulfosuccinate is 562.39 g/mol.
Where can I buy Ditridecyl sulfosuccinate?
You can request a quote for Ditridecyl sulfosuccinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditridecyl sulfosuccinate?
Yes, KEHONG BIO provides custom synthesis services for Ditridecyl sulfosuccinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.