4-Methyl-5-thiazoleethanol acetate
TL;DR: 4-Methyl-5-thiazoleethanol acetate (CAS 656-53-1) is a chemical compound with molecular formula C8H11NO2S and molecular weight 185.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-1,3-thiazol-5-yl)ethyl acetate
Also Known As: 2-(4-Methylthiazol-5-yl)ethyl acetate, Sulfurol acetate, sulfuryl acetate, 4-Methyl-5-thiazolylethyl acetate, Not Available
| Molecular Formula | C8H11NO2S |
|---|---|
| Molecular Weight | 185.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.05106 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
| Melting Point | 131 °C |
| Boiling Point | 117.00 to 118.00 °C. @ 6.00 mm Hg |
| Density | 1.145-1.149 |
| Solubility | Slightly soluble in water; Soluble in organic solvents |
| Refractive Index | 1.505-1.515 |
Chemical Identifiers
| CAS Number | 656-53-1 |
|---|---|
| SMILES | CC1=C(SC=N1)CCOC(=O)C |
| InChIKey | CRTCWNPLKVVXIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-5-thiazoleethanol acetate (CAS 656-53-1), with molecular formula C8H11NO2S and molecular weight 185.05 g/mol. IUPAC: 2-(4-methyl-1,3-thiazol-5-yl)ethyl acetate.
Chemical Property Profile of 4-Methyl-5-thiazoleethanol acetate
Property Insights of 4-Methyl-5-thiazoleethanol acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-5-thiazoleethanol acetate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-5-thiazoleethanol acetate. Following Lipinski's Rule of Five, 4-Methyl-5-thiazoleethanol acetate has 0 hydrogen bond donor(s) and 4 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 4-Methyl-5-thiazoleethanol acetate?
The CAS number of 4-Methyl-5-thiazoleethanol acetate is 656-53-1.
What is the molecular formula of 4-Methyl-5-thiazoleethanol acetate?
The molecular formula of 4-Methyl-5-thiazoleethanol acetate is C8H11NO2S.
What is the molecular weight of 4-Methyl-5-thiazoleethanol acetate?
The molecular weight of 4-Methyl-5-thiazoleethanol acetate is 185.05 g/mol.
Where can I buy 4-Methyl-5-thiazoleethanol acetate?
You can request a quote for 4-Methyl-5-thiazoleethanol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-5-thiazoleethanol acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-5-thiazoleethanol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.