Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate
TL;DR: Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate (CAS 94094-36-7) is a chemical compound with molecular formula C24H45NO5 and molecular weight 427.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate
Also Known As: EINECS 302-136-9, Bis(2-hydroxyethyl)(octadeca-9,12-dienoyl)ammonium acetate, 9,12-Octadecadienamide, N,N-bis(2-hydroxyethyl)-, monoacetate (salt), bis(2-hydroxyethyl)-[(9E,12E)-octadeca-9,12-dienoyl]azanium acetate
| Molecular Formula | C24H45NO5 |
|---|---|
| Molecular Weight | 427.33 g/mol |
| LogP | 1.9522 |
| Topological Polar Surface Area | 102.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 427.32977 |
| Heavy Atoms | 30 |
| Complexity | 438.87723 |
Chemical Identifiers
| CAS Number | 94094-36-7 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCC(=O)[NH+](CCO)CCO.CC(=O)[O-] |
Product Overview
Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate (CAS 94094-36-7), with molecular formula C24H45NO5 and molecular weight 427.33 g/mol. IUPAC: bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate.
Chemical Property Profile of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate
Property Insights of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate
The XLogP value of 1.9522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate. The TPSA of 102.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate. Following Lipinski's Rule of Five, Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate has 3 hydrogen bond donor(s) and 5 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 Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate?
The CAS number of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate is 94094-36-7.
What is the molecular formula of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate?
The molecular formula of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate is C24H45NO5.
What is the molecular weight of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate?
The molecular weight of Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate is 427.33 g/mol.
Where can I buy Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate?
You can request a quote for Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-hydroxyethyl)-octadeca-9,12-dienoylazanium acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.