Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester
TL;DR: Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester (CAS 72197-96-7) is a chemical compound with molecular formula C18H39O5PS and molecular weight 398.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decan-2-yloxy-bis(2-ethoxyethoxy)-sulfanylidene-λ5-phosphane
Also Known As: S-Decyl O,O-bis(2-ethoxyethyl)phosphorothioate, Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester, decan-2-yloxy-bis(2-ethoxyethoxy)-sulfanylidene-, O-Decan-2-yl O,O-bis(2-ethoxyethyl) phosphorothioate, O-(Decan-2-yl) O,O-bis(2-ethoxyethyl) phosphorothioate
| Molecular Formula | C18H39O5PS |
|---|---|
| Molecular Weight | 398.23 g/mol |
| LogP | 5.4728 |
| Topological Polar Surface Area | 46.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Exact Mass | 398.2256 |
| Heavy Atoms | 25 |
| Complexity | 314.5883 |
Chemical Identifiers
| CAS Number | 72197-96-7 |
|---|---|
| SMILES | CCCCCCCCC(C)OP(=S)(OCCOCC)OCCOCC |
Product Overview
Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester (CAS 72197-96-7), with molecular formula C18H39O5PS and molecular weight 398.23 g/mol. IUPAC: decan-2-yloxy-bis(2-ethoxyethoxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester
Property Insights of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester
The XLogP value of 5.4728 indicates that Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.15 Ų, Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester?
The CAS number of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester is 72197-96-7.
What is the molecular formula of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester?
The molecular formula of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester is C18H39O5PS.
What is the molecular weight of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester?
The molecular weight of Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester is 398.23 g/mol.
Where can I buy Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester?
You can request a quote for Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O,O-bis(2-ethoxyethyl) S-decyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.