Phosphoric acid, diethyl 1-(phenylthio)vinyl ester
TL;DR: Phosphoric acid, diethyl 1-(phenylthio)vinyl ester (CAS 2274-95-5) is a chemical compound with molecular formula C12H17O4PS and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1-phenylsulfanylethenyl phosphate
Also Known As: Shell SD-7554, ENT 25,814, SD 7554, Phosphoric acid, diethyl 1-(phenylthio)vinyl ester, AI3-25814
| Molecular Formula | C12H17O4PS |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 288.0585 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 2274-95-5 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC(=C)SC1=CC=CC=C1 |
| InChIKey | ZRNZYXZZGRWEJZ-UHFFFAOYSA-N |
Product Overview
Phosphoric acid, diethyl 1-(phenylthio)vinyl ester (CAS 2274-95-5), with molecular formula C12H17O4PS and molecular weight 288.06 g/mol. IUPAC: diethyl 1-phenylsulfanylethenyl phosphate.
Chemical Property Profile of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester
Property Insights of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester
The XLogP value of 3.3 indicates that Phosphoric acid, diethyl 1-(phenylthio)vinyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, diethyl 1-(phenylthio)vinyl ester. Following Lipinski's Rule of Five, Phosphoric acid, diethyl 1-(phenylthio)vinyl ester has 0 hydrogen bond donor(s) and 5 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 Phosphoric acid, diethyl 1-(phenylthio)vinyl ester?
The CAS number of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester is 2274-95-5.
What is the molecular formula of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester?
The molecular formula of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester is C12H17O4PS.
What is the molecular weight of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester?
The molecular weight of Phosphoric acid, diethyl 1-(phenylthio)vinyl ester is 288.06 g/mol.
Where can I buy Phosphoric acid, diethyl 1-(phenylthio)vinyl ester?
You can request a quote for Phosphoric acid, diethyl 1-(phenylthio)vinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, diethyl 1-(phenylthio)vinyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, diethyl 1-(phenylthio)vinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.