1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol
TL;DR: 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol (CAS 137464-44-9) is a chemical compound with molecular formula C22H42F3O7P and molecular weight 506.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[hydroxy(methoxy)phosphoryl]oxy-3-(2,2,2-trifluoroethoxy)propyl] hexadecanoate
Also Known As: MJ33, MJ 33, 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol, [2-[hydroxy(methoxy)phosphoryl]oxy-3-(2,2,2-trifluoroethoxy)propyl] hexadecanoate, 2-{[hydroxy(methoxy)phosphoryl]oxy}-3-(2,2,2-trifluoroethoxy)propyl hexadecanoate
| Molecular Formula | C22H42F3O7P |
|---|---|
| Molecular Weight | 506.26 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 506.26202 |
| Heavy Atoms | 33 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 137464-44-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COCC(F)(F)F)OP(=O)(O)OC |
| InChIKey | AZTCOMAPQRBIRM-UHFFFAOYSA-N |
Product Overview
1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol (CAS 137464-44-9), with molecular formula C22H42F3O7P and molecular weight 506.26 g/mol. IUPAC: [2-[hydroxy(methoxy)phosphoryl]oxy-3-(2,2,2-trifluoroethoxy)propyl] hexadecanoate.
Chemical Property Profile of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol
Property Insights of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol
The XLogP value of 7.2 indicates that 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol. Following Lipinski's Rule of Five, 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol?
The CAS number of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol is 137464-44-9.
What is the molecular formula of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol?
The molecular formula of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol is C22H42F3O7P.
What is the molecular weight of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol?
The molecular weight of 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol is 506.26 g/mol.
Where can I buy 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol?
You can request a quote for 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexadecyl-3-trifluoroethylglycero-sn-2-phosphomethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.