Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester
TL;DR: Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester (CAS 63950-92-5) is a chemical compound with molecular formula C18H36Cl3O4P and molecular weight 452.1417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[bis(2-ethylhexoxy)phosphoryl]-2,2,2-trichloroethanol
Also Known As: Bis(2-ethylhexyl) 2,2,2-trichloro-1-hydroxyethanephosphonate, 1-[bis(2-ethylhexoxy)phosphoryl]-2,2,2-trichloroethanol, Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester, bis(2-ethylhexyl)(2,2,2-trichloro-1-hydroxyethyl)phosphonate, bis(2-ethylhexyl) (2,2,2-trichloro-1-hydroxyethyl)phosphonate
Technical Specifications
| Molecular Formula | C18H36Cl3O4P |
| Molecular Weight | 452.1417 g/mol |
| XLogP | 7.1 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 452.1417 Da |
| Heavy Atoms | 26 |
| Complexity | 380.0 |
| SMILES | CCCCC(CC)COP(=O)(C(C(Cl)(Cl)Cl)O)OCC(CC)CCCC |
| InChIKey | NWWFRGOWPLIWNG-UHFFFAOYSA-N |
Chemical Property Profile of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester
Property Insights of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester
The XLogP value of 7.1 indicates that Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester?
The CAS number of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester is 63950-92-5.
What is the molecular formula of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester?
The molecular formula of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester is C18H36Cl3O4P.
What is the molecular weight of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester?
The molecular weight of Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester is 452.1417 g/mol.
Where can I buy Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester?
You can request a quote for Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester?
Yes, CoreyChem provides custom synthesis services for Ethanephosphonic acid, 2,2,2-trichloro-1-hydroxy-, bis(2-ethylhexyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.