2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol
TL;DR: 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol (CAS 126828-31-7) is a chemical compound with molecular formula C9H9NO2S and molecular weight 195.0354 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,3-benzoxazol-2-ylsulfanyl)ethanol
Also Known As: 2-(1,3-benzoxazol-2-ylsulfanyl)ethan-1-ol, 2-(Benzo[d]oxazol-2-ylthio)ethan-1-ol, 2-(1,3-benzoxazol-2-ylsulfanyl)ethanol, 2-(2-Benzoxazolylthio)ethanol, Ethanol, 2-(2-benzoxazolylthio)-
Technical Specifications
| Molecular Formula | C9H9NO2S |
| Molecular Weight | 195.0354 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.0354 Da |
| Heavy Atoms | 13 |
| Complexity | 168.0 |
| SMILES | C1=CC=C2C(=C1)N=C(O2)SCCO |
| InChIKey | HRYXZHYVWWYFPY-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol
Property Insights of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol. Following Lipinski's Rule of Five, 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol?
The CAS number of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol is 126828-31-7.
What is the molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol?
The molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol is C9H9NO2S.
What is the molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol?
The molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol is 195.0354 g/mol.
Where can I buy 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol?
You can request a quote for 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol?
Yes, CoreyChem provides custom synthesis services for 2-(1,3-Benzoxazol-2-ylsulfanyl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.