RefChem:234556
TL;DR: RefChem:234556 (CAS 105996-45-0) is a chemical compound with molecular formula C17H28INO2 and molecular weight 405.1165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-dimethyl-propan-2-ylazanium iodide
Also Known As: 2-Hydroxy-N,N-dimethyl-N-(1-methylethyl)-3-(2-(2-propenyl)phenoxy)-1-propanaminium iodide, 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-(1-methylethyl)-3-(2-(2-propenyl)phenoxy)-, iodide, [2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-dimethyl-propan-2-ylazanium iodide, 2-Hydroxy-N,N-dimethyl-N-(propan-2-yl)-3-[2-(prop-2-en-1-yl)phenoxy]propan-1-aminium iodide
Technical Specifications
| Molecular Formula | C17H28INO2 |
| Molecular Weight | 405.1165 g/mol |
| XLogP | -0.3564 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.1165 Da |
| Heavy Atoms | 21 |
| Complexity | 289.0 |
| SMILES | CC(C)[N+](C)(C)CC(COC1=CC=CC=C1CC=C)O.[I-] |
| InChIKey | DENQJOQEDGNSQU-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:234556
Property Insights of RefChem:234556
The XLogP value of -0.3564 indicates that RefChem:234556 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.5 Ų, RefChem:234556 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:234556 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:234556?
The CAS number of RefChem:234556 is 105996-45-0.
What is the molecular formula of RefChem:234556?
The molecular formula of RefChem:234556 is C17H28INO2.
What is the molecular weight of RefChem:234556?
The molecular weight of RefChem:234556 is 405.1165 g/mol.
Where can I buy RefChem:234556?
You can request a quote for RefChem:234556 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:234556?
Yes, CoreyChem provides custom synthesis services for RefChem:234556 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.