3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline
TL;DR: 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline (CAS 133783-55-8) is a chemical compound with molecular formula C10H9F3N2O2S and molecular weight 278.0337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethanol
Also Known As: 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline, 2-(2-Imino-6-trifluoromethoxy-3-benzothiazolinyl)ethanol, 2-[2-imino-6-(trifluoromethoxy)benzothiazol-3-yl]ethanol, 2-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethanol
Technical Specifications
| Molecular Formula | C10H9F3N2O2S |
| Molecular Weight | 278.0337 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 81.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0337 Da |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
| SMILES | C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCO |
| InChIKey | SODICPUNWKPVDQ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline
Property Insights of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline. Following Lipinski's Rule of Five, 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline?
The CAS number of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline is 133783-55-8.
What is the molecular formula of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline?
The molecular formula of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline is C10H9F3N2O2S.
What is the molecular weight of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline?
The molecular weight of 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline is 278.0337 g/mol.
Where can I buy 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline?
You can request a quote for 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline?
Yes, CoreyChem provides custom synthesis services for 3-(2-Hydroxyethyl)-2-imino-6-trifluoromethoxybenzothiazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.