Diethyl 3-ethylsulfanylprop-1-enyl phosphate
TL;DR: Diethyl 3-ethylsulfanylprop-1-enyl phosphate (CAS 5823-29-0) is a chemical compound with molecular formula C9H19O4PS and molecular weight 254.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-ethylsulfanylprop-1-enyl phosphate
Also Known As: Phosphoric acid, diethyl 3-(ethylthio)propenyl ester
| Molecular Formula | C9H19O4PS |
|---|---|
| Molecular Weight | 254.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 254.07417 |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 5823-29-0 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC=CCSCC |
| InChIKey | LOQVMEJRUBEBFD-UHFFFAOYSA-N |
Product Overview
Diethyl 3-ethylsulfanylprop-1-enyl phosphate (CAS 5823-29-0), with molecular formula C9H19O4PS and molecular weight 254.07 g/mol. IUPAC: diethyl 3-ethylsulfanylprop-1-enyl phosphate.
Chemical Property Profile of Diethyl 3-ethylsulfanylprop-1-enyl phosphate
Property Insights of Diethyl 3-ethylsulfanylprop-1-enyl phosphate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 3-ethylsulfanylprop-1-enyl phosphate. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 3-ethylsulfanylprop-1-enyl phosphate. Following Lipinski's Rule of Five, Diethyl 3-ethylsulfanylprop-1-enyl phosphate 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 Diethyl 3-ethylsulfanylprop-1-enyl phosphate?
The CAS number of Diethyl 3-ethylsulfanylprop-1-enyl phosphate is 5823-29-0.
What is the molecular formula of Diethyl 3-ethylsulfanylprop-1-enyl phosphate?
The molecular formula of Diethyl 3-ethylsulfanylprop-1-enyl phosphate is C9H19O4PS.
What is the molecular weight of Diethyl 3-ethylsulfanylprop-1-enyl phosphate?
The molecular weight of Diethyl 3-ethylsulfanylprop-1-enyl phosphate is 254.07 g/mol.
Where can I buy Diethyl 3-ethylsulfanylprop-1-enyl phosphate?
You can request a quote for Diethyl 3-ethylsulfanylprop-1-enyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3-ethylsulfanylprop-1-enyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3-ethylsulfanylprop-1-enyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.