Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate
TL;DR: Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate (CAS 63981-70-4) is a chemical compound with molecular formula C13H21IN2O2 and molecular weight 364.0648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-ethyl-2-(methylcarbamoyloxy)phenyl]-trimethylazanium iodide
Also Known As: T-1722, Carbamic acid, methyl-, (2-ethyl-5-(trimethylammonio)phenyl) ester, iodide, Ammonium, ((4-ethyl-3-methylcarbamoyloxy)phenyl)trimethyl-, iodide, [4-ethyl-2-(methylcarbamoyloxy)phenyl]-trimethylazanium iodide, Carbamic acid, N-methyl-, 3-dimethylamino-6-ethylphenyl ester, methiodide
Technical Specifications
| Molecular Formula | C13H21IN2O2 |
| Molecular Weight | 364.0648 g/mol |
| XLogP | -0.83 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.0648 Da |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
| SMILES | CCC1=CC(=C(C=C1)[N+](C)(C)C)OC(=O)NC.[I-] |
| InChIKey | ITGQHNORHQPLEC-UHFFFAOYSA-N |
Chemical Property Profile of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate
Property Insights of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate
The XLogP value of -0.83 indicates that Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate 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 Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate is 63981-70-4.
What is the molecular formula of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate is C13H21IN2O2.
What is the molecular weight of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate is 364.0648 g/mol.
Where can I buy Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.