Diethanolamine cetyl phosphate
TL;DR: Diethanolamine cetyl phosphate (CAS 61693-41-2) is a chemical compound with molecular formula C20H46NO6P and molecular weight 427.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexadecyl dihydrogen phosphate;2-(2-hydroxyethylamino)ethanol
Also Known As: DEA-Cetyl phosphate, amphisol, BROPHOS A, Diethanolamine cetyl phosphate, Amphisol (emulsifier)
| Molecular Formula | C20H46NO6P |
|---|---|
| Molecular Weight | 427.31 g/mol |
| LogP | 4.14 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 20 |
| Exact Mass | 427.30627 |
| Heavy Atoms | 28 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 61693-41-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO |
| InChIKey | GKKMCECQQIKAHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethanolamine cetyl phosphate (CAS 61693-41-2), with molecular formula C20H46NO6P and molecular weight 427.31 g/mol. IUPAC: hexadecyl dihydrogen phosphate;2-(2-hydroxyethylamino)ethanol.
Chemical Property Profile of Diethanolamine cetyl phosphate
Property Insights of Diethanolamine cetyl phosphate
The XLogP value of 4.14 indicates that Diethanolamine cetyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethanolamine cetyl phosphate. Following Lipinski's Rule of Five, Diethanolamine cetyl phosphate has 5 hydrogen bond donor(s) and 7 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 Diethanolamine cetyl phosphate?
The CAS number of Diethanolamine cetyl phosphate is 61693-41-2.
What is the molecular formula of Diethanolamine cetyl phosphate?
The molecular formula of Diethanolamine cetyl phosphate is C20H46NO6P.
What is the molecular weight of Diethanolamine cetyl phosphate?
The molecular weight of Diethanolamine cetyl phosphate is 427.31 g/mol.
Where can I buy Diethanolamine cetyl phosphate?
You can request a quote for Diethanolamine cetyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethanolamine cetyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Diethanolamine cetyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.