2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide
TL;DR: 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide (CAS 77967-11-4) is a chemical compound with molecular formula C21H30INO and molecular weight 439.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxyethyl(triethyl)azanium iodide
Also Known As: 2-benzhydryloxyethyl(triethyl)azanium iodide, AMMONIUM, (2-(DIPHENYLMETHOXY)ETHYL)TRIETHYL-, IODIDE, beta-(Diphenylmethoxy)-ethyl-triethyl-ammonium-iodide, 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide, Ethanaminium, 2-(diphenylmethoxy)-N,N,N-triethyl-, iodide
| Molecular Formula | C21H30INO |
|---|---|
| Molecular Weight | 439.14 g/mol |
| LogP | 1.67 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 439.1372 |
| Heavy Atoms | 24 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 77967-11-4 |
|---|---|
| SMILES | CC[N+](CC)(CC)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.[I-] |
| InChIKey | DNNNLPRNDBLMAO-UHFFFAOYSA-M |
Product Overview
2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide (CAS 77967-11-4), with molecular formula C21H30INO and molecular weight 439.14 g/mol. IUPAC: 2-benzhydryloxyethyl(triethyl)azanium iodide.
Chemical Property Profile of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide
Property Insights of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide
The XLogP value of 1.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide. With a topological polar surface area (TPSA) of 9.2 Ų, 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide has 0 hydrogen bond donor(s) and 2 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 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide?
The CAS number of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide is 77967-11-4.
What is the molecular formula of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide?
The molecular formula of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide is C21H30INO.
What is the molecular weight of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide?
The molecular weight of 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide is 439.14 g/mol.
Where can I buy 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide?
You can request a quote for 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diphenylmethoxy)-N,N,N-triethylethan-1-aminium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.