Diethyl 1-ethylvinyl phosphate
TL;DR: Diethyl 1-ethylvinyl phosphate (CAS 50522-98-0) is a chemical compound with molecular formula C8H17O4P and molecular weight 208.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-1-en-2-yl diethyl phosphate
Also Known As: Diethyl 1-ethylvinyl phosphate, but-1-en-2-yl diethyl phosphate, Phosphoric acid, diethyl 1-methylenepropyl ester, Phosphoric acid diethyl(1-methylenepropyl) ester, Phosphoric acid diethyl (1-methylenepropyl) ester
| Molecular Formula | C8H17O4P |
|---|---|
| Molecular Weight | 208.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 208.08644 |
| Heavy Atoms | 13 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 50522-98-0 |
|---|---|
| SMILES | CCC(=C)OP(=O)(OCC)OCC |
| InChIKey | CMYJFHSGMRXBKE-UHFFFAOYSA-N |
Product Overview
Diethyl 1-ethylvinyl phosphate (CAS 50522-98-0), with molecular formula C8H17O4P and molecular weight 208.09 g/mol. IUPAC: but-1-en-2-yl diethyl phosphate.
Chemical Property Profile of Diethyl 1-ethylvinyl phosphate
Property Insights of Diethyl 1-ethylvinyl phosphate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 1-ethylvinyl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Diethyl 1-ethylvinyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 1-ethylvinyl phosphate 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 Diethyl 1-ethylvinyl phosphate?
The CAS number of Diethyl 1-ethylvinyl phosphate is 50522-98-0.
What is the molecular formula of Diethyl 1-ethylvinyl phosphate?
The molecular formula of Diethyl 1-ethylvinyl phosphate is C8H17O4P.
What is the molecular weight of Diethyl 1-ethylvinyl phosphate?
The molecular weight of Diethyl 1-ethylvinyl phosphate is 208.09 g/mol.
Where can I buy Diethyl 1-ethylvinyl phosphate?
You can request a quote for Diethyl 1-ethylvinyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 1-ethylvinyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 1-ethylvinyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.