Trimethylolpropane phosphate
TL;DR: Trimethylolpropane phosphate (CAS 1005-93-2) is a chemical compound with molecular formula C6H11O4P and molecular weight 178.03949 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethyl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
Also Known As: Ethyl bicyclic phosphate, TRIMETHYLOLPROPANE PHOSPHATE, Etbicuphat, TMPP-oxide, TMPP (phosphate)
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H11O4P |
| Molecular Weight | 178.03949 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.03949 Da |
| Heavy Atoms | 11 |
| Complexity | 183.0 |
| SMILES | CCC12COP(=O)(OC1)OC2 |
| InChIKey | BYEFHDZWRALTEN-UHFFFAOYSA-N |
Chemical Property Profile of Trimethylolpropane phosphate
Property Insights of Trimethylolpropane phosphate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethylolpropane phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Trimethylolpropane phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethylolpropane 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
What is the CAS number of Trimethylolpropane phosphate?
The CAS number of Trimethylolpropane phosphate is 1005-93-2.
What is the molecular formula of Trimethylolpropane phosphate?
The molecular formula of Trimethylolpropane phosphate is C6H11O4P.
What is the molecular weight of Trimethylolpropane phosphate?
The molecular weight of Trimethylolpropane phosphate is 178.03949 g/mol.
Where can I buy Trimethylolpropane phosphate?
You can request a quote for Trimethylolpropane phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trimethylolpropane phosphate?
Yes, CoreyChem provides custom synthesis services for Trimethylolpropane phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.