Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate
TL;DR: Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate (CAS 69440-47-7) is a chemical compound with molecular formula C13H21BrN2O2 and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-pentylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide
Also Known As: 3-Dimethylcarbamoyloxy-1-pentylpyridinium bromide, Pyridinium, 3-dimethylcarbamoyloxy-1-pentyl-, bromide, Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate, (1-pentylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide, 3-[(DIMETHYLCARBAMOYL)OXY]-1-PENTYLPYRIDIN-1-IUM BROMIDE
| Molecular Formula | C13H21BrN2O2 |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | -0.7713 |
| Topological Polar Surface Area | 33.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.07864 |
| Heavy Atoms | 18 |
| Complexity | 369.7638 |
Chemical Identifiers
| CAS Number | 69440-47-7 |
|---|---|
| SMILES | CCCCC[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-] |
Product Overview
Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate (CAS 69440-47-7), with molecular formula C13H21BrN2O2 and molecular weight 316.08 g/mol. IUPAC: (1-pentylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide.
Chemical Property Profile of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate
Property Insights of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate
The XLogP value of -0.7713 indicates that Pyridinium, 3-hydroxy-1-pentyl-, 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-pentyl-, bromide, dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 3-hydroxy-1-pentyl-, 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-pentyl-, bromide, dimethylcarbamate?
The CAS number of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate is 69440-47-7.
What is the molecular formula of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate?
The molecular formula of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate is C13H21BrN2O2.
What is the molecular weight of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate?
The molecular weight of Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate is 316.08 g/mol.
Where can I buy Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate?
You can request a quote for Pyridinium, 3-hydroxy-1-pentyl-, 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-pentyl-, bromide, dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 3-hydroxy-1-pentyl-, bromide, dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.