Benzyl(ethoxy)oxophosphanium
TL;DR: Benzyl(ethoxy)oxophosphanium (CAS 114425-49-9) is a chemical compound with molecular formula C9H12O2P+ and molecular weight 183.0575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-ethoxy-oxophosphanium
Also Known As: Benzyl(ethoxy)oxophosphanium, ethyl benzylphosphinate, benzyl-ethoxy-oxophosphanium, Benzyl-ethoxy-oxo-phosphanium, Benzyl(ethoxy)(oxo)phosphanium
Technical Specifications
| Molecular Formula | C9H12O2P+ |
| Molecular Weight | 183.0575 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 183.0575 Da |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
| SMILES | CCO[P+](=O)CC1=CC=CC=C1 |
| InChIKey | VKDFMKUOEXNCBQ-UHFFFAOYSA-N |
Chemical Property Profile of Benzyl(ethoxy)oxophosphanium
Property Insights of Benzyl(ethoxy)oxophosphanium
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl(ethoxy)oxophosphanium. With a topological polar surface area (TPSA) of 26.3 Ų, Benzyl(ethoxy)oxophosphanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl(ethoxy)oxophosphanium has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzyl(ethoxy)oxophosphanium?
The CAS number of Benzyl(ethoxy)oxophosphanium is 114425-49-9.
What is the molecular formula of Benzyl(ethoxy)oxophosphanium?
The molecular formula of Benzyl(ethoxy)oxophosphanium is C9H12O2P+.
What is the molecular weight of Benzyl(ethoxy)oxophosphanium?
The molecular weight of Benzyl(ethoxy)oxophosphanium is 183.0575 g/mol.
Where can I buy Benzyl(ethoxy)oxophosphanium?
You can request a quote for Benzyl(ethoxy)oxophosphanium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzyl(ethoxy)oxophosphanium?
Yes, CoreyChem provides custom synthesis services for Benzyl(ethoxy)oxophosphanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.