2-Dodecanoylamino-1-hexanolphosphocholine
TL;DR: 2-Dodecanoylamino-1-hexanolphosphocholine (CAS 131736-67-9) is a chemical compound with molecular formula C23H49N2O5P and molecular weight 464.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dodecanoylamino)hexyl 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: Amide-PC, DAHPC, 2-Dodecanoylamino-1-hexanolphosphocholine, J2.713.190E, 2-(dodecanoylamino)hexyl 2-(trimethylazaniumyl)ethyl phosphate
| Molecular Formula | C23H49N2O5P |
|---|---|
| Molecular Weight | 464.34 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 21 |
| Exact Mass | 464.33792 |
| Heavy Atoms | 31 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 131736-67-9 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)NC(CCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChIKey | NZECISUDKBBTDE-UHFFFAOYSA-N |
Product Overview
2-Dodecanoylamino-1-hexanolphosphocholine (CAS 131736-67-9), with molecular formula C23H49N2O5P and molecular weight 464.34 g/mol. IUPAC: 2-(dodecanoylamino)hexyl 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 2-Dodecanoylamino-1-hexanolphosphocholine
Property Insights of 2-Dodecanoylamino-1-hexanolphosphocholine
The XLogP value of 5.3 indicates that 2-Dodecanoylamino-1-hexanolphosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Dodecanoylamino-1-hexanolphosphocholine. Following Lipinski's Rule of Five, 2-Dodecanoylamino-1-hexanolphosphocholine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Dodecanoylamino-1-hexanolphosphocholine?
The CAS number of 2-Dodecanoylamino-1-hexanolphosphocholine is 131736-67-9.
What is the molecular formula of 2-Dodecanoylamino-1-hexanolphosphocholine?
The molecular formula of 2-Dodecanoylamino-1-hexanolphosphocholine is C23H49N2O5P.
What is the molecular weight of 2-Dodecanoylamino-1-hexanolphosphocholine?
The molecular weight of 2-Dodecanoylamino-1-hexanolphosphocholine is 464.34 g/mol.
Where can I buy 2-Dodecanoylamino-1-hexanolphosphocholine?
You can request a quote for 2-Dodecanoylamino-1-hexanolphosphocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Dodecanoylamino-1-hexanolphosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 2-Dodecanoylamino-1-hexanolphosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.