Phosphorothioic acid, O,O-diethyl S-hexyl ester
TL;DR: Phosphorothioic acid, O,O-diethyl S-hexyl ester (CAS 6324-55-6) is a chemical compound with molecular formula C10H23O3PS and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-hexan-2-yloxy-sulfanylidene-λ5-phosphane
Also Known As: O,O-Diethyl S-hexyl phosphorothioate, o,o-diethyl o-hexan-2-yl phosphorothioate, diethoxy-hexan-2-yloxy-sulfanylidene-, Phosphorothioic acid, O,O-diethyl S-hexyl ester, Phosphorodichloridothious acid, phenyl ester
| Molecular Formula | C10H23O3PS |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 254.11055 |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 6324-55-6 |
|---|---|
| SMILES | CCCCC(C)OP(=S)(OCC)OCC |
| InChIKey | FUHNJWGKVQRFEE-UHFFFAOYSA-N |
Product Overview
Phosphorothioic acid, O,O-diethyl S-hexyl ester (CAS 6324-55-6), with molecular formula C10H23O3PS and molecular weight 254.11 g/mol. IUPAC: diethoxy-hexan-2-yloxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorothioic acid, O,O-diethyl S-hexyl ester
Property Insights of Phosphorothioic acid, O,O-diethyl S-hexyl ester
The XLogP value of 4.2 indicates that Phosphorothioic acid, O,O-diethyl S-hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, Phosphorothioic acid, O,O-diethyl S-hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorothioic acid, O,O-diethyl S-hexyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O,O-diethyl S-hexyl ester?
The CAS number of Phosphorothioic acid, O,O-diethyl S-hexyl ester is 6324-55-6.
What is the molecular formula of Phosphorothioic acid, O,O-diethyl S-hexyl ester?
The molecular formula of Phosphorothioic acid, O,O-diethyl S-hexyl ester is C10H23O3PS.
What is the molecular weight of Phosphorothioic acid, O,O-diethyl S-hexyl ester?
The molecular weight of Phosphorothioic acid, O,O-diethyl S-hexyl ester is 254.11 g/mol.
Where can I buy Phosphorothioic acid, O,O-diethyl S-hexyl ester?
You can request a quote for Phosphorothioic acid, O,O-diethyl S-hexyl 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-diethyl S-hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O,O-diethyl S-hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.