Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate
TL;DR: Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate (CAS 69440-43-3) is a chemical compound with molecular formula C11H17BrN2O2 and molecular weight 288.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-propan-2-ylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide
Also Known As: 3-Dimethylcarbamoyloxy-1-isopropylpyridinium bromide, Pyridinium, 3-dimethylcarbamoyloxy-1-isopropyl-, bromide, Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate, 3-((dimethylcarbamoyl)oxy)-1-isopropylpyridin-1-ium bromide, N,N-dimethylcarbamate,1-propan-2-ylpyridin-1-ium-3-ol,bromide
| Molecular Formula | C11H17BrN2O2 |
|---|---|
| Molecular Weight | 288.05 g/mol |
| LogP | -1.3806 |
| Topological Polar Surface Area | 33.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.04733 |
| Heavy Atoms | 16 |
| Complexity | 353.59274 |
Chemical Identifiers
| CAS Number | 69440-43-3 |
|---|---|
| SMILES | CC(C)[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-] |
Product Overview
Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate (CAS 69440-43-3), with molecular formula C11H17BrN2O2 and molecular weight 288.05 g/mol. IUPAC: (1-propan-2-ylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide.
Chemical Property Profile of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate
Property Insights of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate
The XLogP value of -1.3806 indicates that Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.42 Ų, Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate has 0 hydrogen bond donor(s) and 2 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 Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate?
The CAS number of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate is 69440-43-3.
What is the molecular formula of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate?
The molecular formula of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate is C11H17BrN2O2.
What is the molecular weight of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate?
The molecular weight of Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate is 288.05 g/mol.
Where can I buy Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate?
You can request a quote for Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 3-hydroxy-1-isopropyl-, bromide, dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.