1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)
TL;DR: 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) (CAS 61909-18-0) is a chemical compound with molecular formula C27H58IN and molecular weight 523.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trioctyl(propyl)azanium iodide
Also Known As: propyltrioctylammonium iodide, trioctyl(propyl)azanium iodide, 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide, n,n-dioctyl-n-propyloctan-1-aminium iodide, 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)
| Molecular Formula | C27H58IN |
|---|---|
| Molecular Weight | 523.36 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 23 |
| Exact Mass | 523.3614 |
| Heavy Atoms | 29 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 61909-18-0 |
|---|---|
| SMILES | CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.[I-] |
| InChIKey | RGBJYTMHKCMMOJ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) (CAS 61909-18-0), with molecular formula C27H58IN and molecular weight 523.36 g/mol. IUPAC: trioctyl(propyl)azanium iodide.
Chemical Property Profile of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)
Property Insights of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)
The XLogP value of 6.3 indicates that 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)?
The CAS number of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) is 61909-18-0.
What is the molecular formula of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)?
The molecular formula of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) is C27H58IN.
What is the molecular weight of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)?
The molecular weight of 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) is 523.36 g/mol.
Where can I buy 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)?
You can request a quote for 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Octanaminium, N,N-dioctyl-N-propyl-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.