Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide
TL;DR: Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide (CAS 7347-89-9) is a chemical compound with molecular formula C21H28INO and molecular weight 437.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(2-benzylphenoxy)propan-2-yl]-1-methylpyrrolidin-1-ium iodide
Also Known As: 1-(1-((2-Benzylphenoxy)methyl)ethyl)-1-methylpyrrolidinium iodide, Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide, 1-[1-(2-benzylphenoxy)propan-2-yl]-1-methylpyrrolidin-1-ium iodide, Pyrrolidinium, 1-methyl-1-[1-methyl-2-[2-(phenylmethyl)phenoxy]ethyl]-, iodide, RefChem:378126
| Molecular Formula | C21H28INO |
|---|---|
| Molecular Weight | 437.12 g/mol |
| LogP | 1.2891 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.12155 |
| Heavy Atoms | 24 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 7347-89-9 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1CC2=CC=CC=C2)[N+]3(CCCC3)C.[I-] |
| InChIKey | OJSQKXOXMSXVLR-UHFFFAOYSA-M |
Product Overview
Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide (CAS 7347-89-9), with molecular formula C21H28INO and molecular weight 437.12 g/mol. IUPAC: 1-[1-(2-benzylphenoxy)propan-2-yl]-1-methylpyrrolidin-1-ium iodide.
Chemical Property Profile of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide
Property Insights of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide
The XLogP value of 1.2891 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide. With a topological polar surface area (TPSA) of 9.2 Ų, Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, 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 Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide?
The CAS number of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide is 7347-89-9.
What is the molecular formula of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide?
The molecular formula of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide is C21H28INO.
What is the molecular weight of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide?
The molecular weight of Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide is 437.12 g/mol.
Where can I buy Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide?
You can request a quote for Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidinium, 1-(1-((2-benzylphenoxy)methyl)ethyl)-1-methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.