Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide
TL;DR: Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide (CAS 69095-10-9) is a chemical compound with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-tert-butylpyridin-1-ium-1-yl)ethyl acetate bromide
Also Known As: HB 6, 1-(2-(Acetyloxy)ethyl)-4-(1,1-dimethylethyl)pyridinium bromide, Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide, 2-(4-tert-butylpyridin-1-ium-1-yl)ethyl acetate bromide, 1-(2-(ACETYLOXY)ETHYL)-4-(TERT-BUTYL)PYRIDINIUM BROMIDE
| Molecular Formula | C13H20BrNO2 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | -1.1613 |
| Topological Polar Surface Area | 30.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.06775 |
| Heavy Atoms | 17 |
| Complexity | 354.67737 |
Chemical Identifiers
| CAS Number | 69095-10-9 |
|---|---|
| SMILES | CC(=O)OCC[N+]1=CC=C(C=C1)C(C)(C)C.[Br-] |
Product Overview
Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide (CAS 69095-10-9), with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol. IUPAC: 2-(4-tert-butylpyridin-1-ium-1-yl)ethyl acetate bromide.
Chemical Property Profile of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide
Property Insights of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide
The XLogP value of -1.1613 indicates that Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.18 Ų, Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide 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, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide?
The CAS number of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide is 69095-10-9.
What is the molecular formula of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide?
The molecular formula of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide is C13H20BrNO2.
What is the molecular weight of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide?
The molecular weight of Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide is 301.07 g/mol.
Where can I buy Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide?
You can request a quote for Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.