RefChem:189598
TL;DR: RefChem:189598 (CAS 3031-21-8) is a chemical compound with molecular formula C12H28O4P2S4 and molecular weight 426.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[di(propan-2-yloxy)phosphinothioyldisulfanyl]-di(propan-2-yloxy)-sulfanylidene-λ5-phosphane
Also Known As: Tetraisopropyl thioperoxydiphosphate, bis(diisopropoxythiophosphoryl)disulfide, Bis(diisopropoxythiophophinyl) persulfide, Bis(diisopropoxyphosphinothioyl) persulfide, Bis(diisopropoxythiophophinyl) perdisulfide
| Molecular Formula | C12H28O4P2S4 |
|---|---|
| Molecular Weight | 426.03 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 426.03458 |
| Heavy Atoms | 22 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 3031-21-8 |
|---|---|
| SMILES | CC(C)OP(=S)(OC(C)C)SSP(=S)(OC(C)C)OC(C)C |
| InChIKey | YEOPWSIDXUQFJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:189598 (CAS 3031-21-8), with molecular formula C12H28O4P2S4 and molecular weight 426.03 g/mol. IUPAC: [di(propan-2-yloxy)phosphinothioyldisulfanyl]-di(propan-2-yloxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of RefChem:189598
Property Insights of RefChem:189598
The XLogP value of 6.4 indicates that RefChem:189598 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.0 Ų indicates high polarity, suggesting RefChem:189598 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:189598 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:189598?
The CAS number of RefChem:189598 is 3031-21-8.
What is the molecular formula of RefChem:189598?
The molecular formula of RefChem:189598 is C12H28O4P2S4.
What is the molecular weight of RefChem:189598?
The molecular weight of RefChem:189598 is 426.03 g/mol.
Where can I buy RefChem:189598?
You can request a quote for RefChem:189598 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:189598?
Yes, KEHONG BIO provides custom synthesis services for RefChem:189598 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.