O,O-Bis(2-ethylhexyl) hydrogen thiophosphate
TL;DR: O,O-Bis(2-ethylhexyl) hydrogen thiophosphate (CAS 17618-27-8) is a chemical compound with molecular formula C16H35O3PS and molecular weight 338.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-ethylhexoxy)-hydroxy-sulfanylidene-λ5-phosphane
Also Known As: Bis(2-ethylhexyl) thiophosphate, O,O-Bis(2-ethylhexyl) hydrogen thiophosphate, bis(2-ethylhexyl) sulfanylphosphonate, di(2-ethylhexyl)monothiophosphoric acid, O,O-Bis(2-ethylhexyl) hydrogen phosphorothioate
| Molecular Formula | C16H35O3PS |
|---|---|
| Molecular Weight | 338.20 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 338.20447 |
| Heavy Atoms | 21 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 17618-27-8 |
|---|---|
| SMILES | CCCCC(CC)COP(=S)(O)OCC(CC)CCCC |
| InChIKey | TVRJUOAQXLUUGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O,O-Bis(2-ethylhexyl) hydrogen thiophosphate (CAS 17618-27-8), with molecular formula C16H35O3PS and molecular weight 338.20 g/mol. IUPAC: bis(2-ethylhexoxy)-hydroxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate
Property Insights of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate
The XLogP value of 7.0 indicates that O,O-Bis(2-ethylhexyl) hydrogen thiophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-Bis(2-ethylhexyl) hydrogen thiophosphate. Following Lipinski's Rule of Five, O,O-Bis(2-ethylhexyl) hydrogen thiophosphate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate?
The CAS number of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate is 17618-27-8.
What is the molecular formula of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate?
The molecular formula of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate is C16H35O3PS.
What is the molecular weight of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate?
The molecular weight of O,O-Bis(2-ethylhexyl) hydrogen thiophosphate is 338.20 g/mol.
Where can I buy O,O-Bis(2-ethylhexyl) hydrogen thiophosphate?
You can request a quote for O,O-Bis(2-ethylhexyl) hydrogen thiophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Bis(2-ethylhexyl) hydrogen thiophosphate?
Yes, KEHONG BIO provides custom synthesis services for O,O-Bis(2-ethylhexyl) hydrogen thiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.