3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide
TL;DR: 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide (CAS 63977-54-8) is a chemical compound with molecular formula C12H20INO and molecular weight 321.05896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-methoxy-4,5-dimethylphenyl)-trimethylazanium iodide
Also Known As: Ro 2-3512, (3,4-Dimethyl-5-methoxyphenyl)trimethylammonium iodide, (3-methoxy-4,5-dimethylphenyl)-trimethylazanium iodide, 3-methoxy-N,N,N,4,5-pentamethylanilinium iodide, AMMONIUM, (3,4-DIMETHYL-5-METHOXYPHENYL)TRIMETHYL-, IODIDE
Technical Specifications
| Molecular Formula | C12H20INO |
| Molecular Weight | 321.05896 g/mol |
| XLogP | -0.49 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.05896 Da |
| Heavy Atoms | 15 |
| Complexity | 185.0 |
| SMILES | CC1=CC(=CC(=C1C)OC)[N+](C)(C)C.[I-] |
| InChIKey | XXBSNFDFXXRLKZ-UHFFFAOYSA-M |
Chemical Property Profile of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide
Property Insights of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide
The XLogP value of -0.49 indicates that 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-N,N,N,4,5-pentamethylanilinium 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
What is the CAS number of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide?
The CAS number of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide is 63977-54-8.
What is the molecular formula of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide?
The molecular formula of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide is C12H20INO.
What is the molecular weight of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide?
The molecular weight of 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide is 321.05896 g/mol.
Where can I buy 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide?
You can request a quote for 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide?
Yes, CoreyChem provides custom synthesis services for 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.