Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate
TL;DR: Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate (CAS 123691-86-1) is a chemical compound with molecular formula C9H16NO3P and molecular weight 217.08678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[ethoxy(oxolan-2-yl)phosphoryl]propanenitrile
Also Known As: ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate, 3-(ethoxy-(oxolan-2-yl)phosphoryl)propanenitrile
Technical Specifications
| Molecular Formula | C9H16NO3P |
| Molecular Weight | 217.08678 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 217.08678 Da |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
| SMILES | CCOP(=O)(CCC#N)C1CCCO1 |
| InChIKey | HXLTUMSNDXOIET-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate
Property Insights of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate. With a topological polar surface area (TPSA) of 59.3 Ų, Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate 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
What is the CAS number of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate?
The CAS number of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate is 123691-86-1.
What is the molecular formula of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate?
The molecular formula of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate is C9H16NO3P.
What is the molecular weight of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate?
The molecular weight of Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate is 217.08678 g/mol.
Where can I buy Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate?
You can request a quote for Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-cyanoethyl(tetrahydrofuran-2-yl)-phosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.