hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt
TL;DR: hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt (CAS 65059-71-4) is a chemical compound with molecular formula C20H39NO2 and molecular weight 325.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[hexadec-1-enyl(dimethyl)azaniumyl]acetate
Also Known As: Hexadecen-1-aminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt, Ammonium, (carboxymethyl)hexadecenyldimethyl-, hydroxide, inner salt, Hexadecen-1-aminium, N-(carboxymethyl)-N,N-dimethyl-, hydroxide, inner salt, RefChem:145972
| Molecular Formula | C20H39NO2 |
|---|---|
| Molecular Weight | 325.30 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 325.29807 |
| Heavy Atoms | 23 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 65059-71-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCC=C[N+](C)(C)CC(=O)[O-] |
| InChIKey | QXEIANCKXCCTMW-UHFFFAOYSA-N |
Product Overview
hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt (CAS 65059-71-4), with molecular formula C20H39NO2 and molecular weight 325.30 g/mol. IUPAC: 2-[hexadec-1-enyl(dimethyl)azaniumyl]acetate.
Chemical Property Profile of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt
Property Insights of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt
The XLogP value of 8.2 indicates that hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.1 Ų, hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt?
The CAS number of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt is 65059-71-4.
What is the molecular formula of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt?
The molecular formula of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt is C20H39NO2.
What is the molecular weight of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt?
The molecular weight of hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt is 325.30 g/mol.
Where can I buy hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt?
You can request a quote for hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt?
Yes, KEHONG BIO provides custom synthesis services for hexadecen-1-aminium, n-(carboxymethyl)-n,n-dimethyl-, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.