Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester
TL;DR: Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester (CAS 104702-32-1) is a chemical compound with molecular formula C9H22NO4P and molecular weight 239.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl 2-(methylazaniumyl)ethyl phosphate
Also Known As: Hexyl-N-Me-Cephalin, Hexyl-phosphatidyl-N-methyl-ethanolamine, hexyl 2-(methylazaniumyl)ethyl phosphate, Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester, hexyl 2-(methylamino)ethyl hydrogen phosphate
| Molecular Formula | C9H22NO4P |
|---|---|
| Molecular Weight | 239.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 239.12865 |
| Heavy Atoms | 15 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 104702-32-1 |
|---|---|
| SMILES | CCCCCCOP(=O)([O-])OCC[NH2+]C |
| InChIKey | NYGAMHRIFHIGKG-UHFFFAOYSA-N |
Product Overview
Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester (CAS 104702-32-1), with molecular formula C9H22NO4P and molecular weight 239.13 g/mol. IUPAC: hexyl 2-(methylazaniumyl)ethyl phosphate.
Chemical Property Profile of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester
Property Insights of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester. Following Lipinski's Rule of Five, Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester?
The CAS number of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester is 104702-32-1.
What is the molecular formula of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester?
The molecular formula of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester is C9H22NO4P.
What is the molecular weight of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester?
The molecular weight of Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester is 239.13 g/mol.
Where can I buy Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester?
You can request a quote for Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, monohexyl mono(2-(methylamino)ethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.