Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate
TL;DR: Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate (CAS 64046-29-3) is a chemical compound with molecular formula C13H21IN2O2 and molecular weight 364.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[[5-methyl-2-(methylcarbamoyloxy)phenyl]methyl]azanium iodide
Also Known As: T-1893, Carbamic acid, methyl-, 2-(trimethylammoniomethyl)-p-tolyl ester, iodide, Ammonium, ((2-(methylcarbamoyloxy)-5-methyl)phenylmethyl)trimethyl-, iodide, AMMONIUM, ((2-HYDROXY-5-METHYL)BENZYL)TRIMETHYL-, IODIDE, METHYLCARBAMATE, Ammonium, ((2-hydroxy-5-methylphenyl)methyl)trimethyl-, iodide, methylcarbamate
| Molecular Formula | C13H21IN2O2 |
|---|---|
| Molecular Weight | 364.06 g/mol |
| LogP | -1.08 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.0648 |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 64046-29-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC(=O)NC)C[N+](C)(C)C.[I-] |
| InChIKey | SLKUUEUSUIOTAU-UHFFFAOYSA-N |
Product Overview
Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate (CAS 64046-29-3), with molecular formula C13H21IN2O2 and molecular weight 364.06 g/mol. IUPAC: trimethyl-[[5-methyl-2-(methylcarbamoyloxy)phenyl]methyl]azanium iodide.
Chemical Property Profile of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate
Property Insights of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate
The XLogP value of -1.08 indicates that Ammonium, ((2-hydroxy-5-methyl)benzyl)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, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, ((2-hydroxy-5-methyl)benzyl)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
Frequently Asked Questions
What is the CAS number of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate is 64046-29-3.
What is the molecular formula of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate is C13H21IN2O2.
What is the molecular weight of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate is 364.06 g/mol.
Where can I buy Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, ((2-hydroxy-5-methyl)benzyl)trimethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.