2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium
TL;DR: 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium (CAS 51169-57-4) is a chemical compound with molecular formula C7H12BrNOS and molecular weight 236.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)ethanol bromide
Also Known As: 2-HE-Dmt, 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium bromide, 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium, Thiazolium, 2-(1-hydroxyethyl)-3,4-dimethyl-, bromide, 1-(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)ethanol;bromide
| Molecular Formula | C7H12BrNOS |
|---|---|
| Molecular Weight | 236.98 g/mol |
| LogP | -2.06168 |
| Topological Polar Surface Area | 24.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.9823 |
| Heavy Atoms | 11 |
| Complexity | 234.34448 |
Chemical Identifiers
| CAS Number | 51169-57-4 |
|---|---|
| SMILES | CC1=CSC(=[N+]1C)C(C)O.[Br-] |
Product Overview
2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium (CAS 51169-57-4), with molecular formula C7H12BrNOS and molecular weight 236.98 g/mol. IUPAC: 1-(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)ethanol bromide.
Chemical Property Profile of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium
Property Insights of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium
The XLogP value of -2.06168 indicates that 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.11 Ų, 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium has 1 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 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium?
The CAS number of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium is 51169-57-4.
What is the molecular formula of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium?
The molecular formula of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium is C7H12BrNOS.
What is the molecular weight of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium?
The molecular weight of 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium is 236.98 g/mol.
Where can I buy 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium?
You can request a quote for 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium?
Yes, KEHONG BIO provides custom synthesis services for 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.