3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester
TL;DR: 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester (CAS 50708-20-8) is a chemical compound with molecular formula C11H19O8P and molecular weight 310.08176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 3-diethoxyphosphoryloxypent-2-enedioate
Also Known As: GC 3661, dimethyl 3-diethoxyphosphoryloxypent-2-enedioate, dimethyl (E)-3-diethoxyphosphoryloxypent-2-enedioate, 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester, Glutaconic acid, 3-hydroxy-, dimethyl ester, diethyl phosphate
Technical Specifications
| Molecular Formula | C11H19O8P |
| Molecular Weight | 310.08176 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 97.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 310.08176 Da |
| Heavy Atoms | 20 |
| Complexity | 393.0 |
| SMILES | CCOP(=O)(OCC)OC(=CC(=O)OC)CC(=O)OC |
| InChIKey | YGFYXQXOXCSYJW-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester
Property Insights of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester. Following Lipinski's Rule of Five, 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester?
The CAS number of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester is 50708-20-8.
What is the molecular formula of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester?
The molecular formula of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester is C11H19O8P.
What is the molecular weight of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester?
The molecular weight of 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester is 310.08176 g/mol.
Where can I buy 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester?
You can request a quote for 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester?
Yes, CoreyChem provides custom synthesis services for 3-(Diethoxyphosphinyloxy)-2-pentenedioic acid dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.