Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester
TL;DR: Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester (CAS 63980-89-2) is a chemical compound with molecular formula C9H13O3PS and molecular weight 232.0323 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethoxy-(4-methylphenyl)sulfanylphosphinic acid
Also Known As: 1-dodecyl-3-phenylthiourea, O-Ethyl S-(p-tolyl) phosphorothioate, Phosphorothioic acid, O-ethyl S-(p-tolyl) ester, ethoxy-(4-methylphenyl)sulfanylphosphinic acid, ThiophosphoricacidhydrogenO-ethylS- ester
Technical Specifications
| Molecular Formula | C9H13O3PS |
| Molecular Weight | 232.0323 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.0323 Da |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
| SMILES | CCOP(=O)(O)SC1=CC=C(C=C1)C |
| InChIKey | PPAVHHVBWSUYDY-UHFFFAOYSA-N |
Chemical Property Profile of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester
Property Insights of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester. Following Lipinski's Rule of Five, Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester?
The CAS number of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester is 63980-89-2.
What is the molecular formula of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester?
The molecular formula of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester is C9H13O3PS.
What is the molecular weight of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester?
The molecular weight of Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester is 232.0323 g/mol.
Where can I buy Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester?
You can request a quote for Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester?
Yes, CoreyChem provides custom synthesis services for Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.