1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide
TL;DR: 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide (CAS 14134-81-7) is a chemical compound with molecular formula C13H18IN and molecular weight 315.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethyl-2,3,3-trimethylindol-1-ium iodide
Also Known As: 1-Ethyl-2,3,3-trimethyl-3H-indol-1-ium iodide, 1-Ethyl-2,3,3-trimethylindolenium Iodide, 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide, 3H-Indolium, 1-ethyl-2,3,3-trimethyl-, iodide, 3H-Indolium, 1-ethyl-2,3,3-trimethyl-, iodide (1:1)
Technical Specifications
| Molecular Formula | C13H18IN |
| Molecular Weight | 315.0484 g/mol |
| XLogP | 0.1066 |
| Topological Polar Surface Area (TPSA) | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.0484 Da |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
| SMILES | CC[N+]1=C(C(C2=CC=CC=C21)(C)C)C.[I-] |
| InChIKey | WHXDRZOCHPMFIX-UHFFFAOYSA-M |
Chemical Property Profile of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide
Property Insights of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide
The XLogP value of 0.1066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide. With a topological polar surface area (TPSA) of 3.0 Ų, 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide?
The CAS number of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide is 14134-81-7.
What is the molecular formula of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide?
The molecular formula of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide is C13H18IN.
What is the molecular weight of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide?
The molecular weight of 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide is 315.0484 g/mol.
Where can I buy 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide?
You can request a quote for 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide?
Yes, CoreyChem provides custom synthesis services for 1-Ethyl-2,3,3-trimethyl-3H-indolium Iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.