N,N-Diethylethanaminium heptadecafluorononanoate
TL;DR: N,N-Diethylethanaminium heptadecafluorononanoate (CAS 327176-80-7) is a chemical compound with molecular formula C15H16F17NO2 and molecular weight 565.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylethanamine;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoic acid
Also Known As: N,N-Diethylethanaminium heptadecafluorononanoate, N,N-diethylethanamine; 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoic acid, Nonanoic acid, heptadecafluoro-, compd. with N,N-diethylethanamine (1:1) (9CI), RefChem:359101
| Molecular Formula | C15H16F17NO2 |
|---|---|
| Molecular Weight | 565.09 g/mol |
| LogP | 6.4285 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 10 |
| Exact Mass | 565.09094 |
| Heavy Atoms | 35 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 327176-80-7 |
|---|---|
| SMILES | CCN(CC)CC.C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O |
| InChIKey | VHKGZTFLSZRKOS-UHFFFAOYSA-N |
Product Overview
N,N-Diethylethanaminium heptadecafluorononanoate (CAS 327176-80-7), with molecular formula C15H16F17NO2 and molecular weight 565.09 g/mol. IUPAC: N,N-diethylethanamine;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoic acid.
Chemical Property Profile of N,N-Diethylethanaminium heptadecafluorononanoate
Property Insights of N,N-Diethylethanaminium heptadecafluorononanoate
The XLogP value of 6.4285 indicates that N,N-Diethylethanaminium heptadecafluorononanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, N,N-Diethylethanaminium heptadecafluorononanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethylethanaminium heptadecafluorononanoate has 1 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Diethylethanaminium heptadecafluorononanoate?
The CAS number of N,N-Diethylethanaminium heptadecafluorononanoate is 327176-80-7.
What is the molecular formula of N,N-Diethylethanaminium heptadecafluorononanoate?
The molecular formula of N,N-Diethylethanaminium heptadecafluorononanoate is C15H16F17NO2.
What is the molecular weight of N,N-Diethylethanaminium heptadecafluorononanoate?
The molecular weight of N,N-Diethylethanaminium heptadecafluorononanoate is 565.09 g/mol.
Where can I buy N,N-Diethylethanaminium heptadecafluorononanoate?
You can request a quote for N,N-Diethylethanaminium heptadecafluorononanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethylethanaminium heptadecafluorononanoate?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethylethanaminium heptadecafluorononanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.