Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate
TL;DR: Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate (CAS 4498-44-6) is a chemical compound with molecular formula C12H19IN2O2 and molecular weight 350.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-(phenylcarbamoyloxy)ethyl]azanium iodide
Also Known As: Choline, iodide, carbanilate, Carbamic acid, phenyl-, 2-(trimethylammonio)ethyl ester, iodide, Ammonium, (2-(N-phenylcarbamoyloxy)ethyl)trimethyl-, iodide, Carbamic acid, N-phenyl-, 2-dimethylaminoethyl ester, methiodide, AMMONIUM, (2-HYDROXYETHYL)TRIMETHYL-, IODIDE, PHENYLCARBAMATE
| Molecular Formula | C12H19IN2O2 |
|---|---|
| Molecular Weight | 350.05 g/mol |
| LogP | -1.05 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.04913 |
| Heavy Atoms | 17 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 4498-44-6 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)NC1=CC=CC=C1.[I-] |
| InChIKey | UKLGVRWTJYJAIX-UHFFFAOYSA-N |
Product Overview
Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate (CAS 4498-44-6), with molecular formula C12H19IN2O2 and molecular weight 350.05 g/mol. IUPAC: trimethyl-[2-(phenylcarbamoyloxy)ethyl]azanium iodide.
Chemical Property Profile of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate
Property Insights of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate
The XLogP value of -1.05 indicates that Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate 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-hydroxyethyl)trimethyl-, iodide, phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate 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-hydroxyethyl)trimethyl-, iodide, phenylcarbamate?
The CAS number of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate is 4498-44-6.
What is the molecular formula of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate?
The molecular formula of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate is C12H19IN2O2.
What is the molecular weight of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate?
The molecular weight of Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate is 350.05 g/mol.
Where can I buy Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate?
You can request a quote for Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-hydroxyethyl)trimethyl-, iodide, phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.