2-Acetyl-2-thiazoline
TL;DR: 2-Acetyl-2-thiazoline (CAS 3519-25-3) is a chemical compound with molecular formula C5H7NOS and molecular weight 129.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dihydro-1,3-thiazol-2-yl)ethanone
Also Known As: 2-Acetyl-2-thiazoline, 2-acetylthiazoline, null, 1-(4,5-dihydrothiazol-2-yl)ethanone, acetylthiazoline
| Molecular Formula | C5H7NOS |
|---|---|
| Molecular Weight | 129.02 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.02484 |
| Heavy Atoms | 8 |
| Complexity | 141.0 |
| Melting Point | 25 - 26 °C |
| Boiling Point | 222.00 to 223.00 °C. @ 760.00 mm Hg |
| Solubility | Insoluble in water and heptane |
Chemical Identifiers
| CAS Number | 3519-25-3 |
|---|---|
| SMILES | CC(=O)C1=NCCS1 |
| InChIKey | FZOZFDAMVVEZSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Acetyl-2-thiazoline (CAS 3519-25-3), with molecular formula C5H7NOS and molecular weight 129.02 g/mol. IUPAC: 1-(4,5-dihydro-1,3-thiazol-2-yl)ethanone.
Chemical Property Profile of 2-Acetyl-2-thiazoline
Property Insights of 2-Acetyl-2-thiazoline
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetyl-2-thiazoline. With a topological polar surface area (TPSA) of 54.7 Ų, 2-Acetyl-2-thiazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetyl-2-thiazoline has 0 hydrogen bond donor(s) and 3 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-Acetyl-2-thiazoline?
The CAS number of 2-Acetyl-2-thiazoline is 3519-25-3.
What is the molecular formula of 2-Acetyl-2-thiazoline?
The molecular formula of 2-Acetyl-2-thiazoline is C5H7NOS.
What is the molecular weight of 2-Acetyl-2-thiazoline?
The molecular weight of 2-Acetyl-2-thiazoline is 129.02 g/mol.
Where can I buy 2-Acetyl-2-thiazoline?
You can request a quote for 2-Acetyl-2-thiazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetyl-2-thiazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-2-thiazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.