2-Hexanol, 1-tert-butylthio-
TL;DR: 2-Hexanol, 1-tert-butylthio- (CAS 152517-47-0) is a chemical compound with molecular formula C10H22OS and molecular weight 190.13913 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-tert-butylsulfanylhexan-2-ol
Also Known As: 2-Hexanol, 1-tert-butylthio-, 1-tert-butylsulfanylhexan-2-ol, 1-(tert-Butylsulfanyl)hexan-2-ol, 1-(tert-Butylsulfanyl)-2-hexanol #, 1-[(1,1-Dimethylethyl)thio]-2-hexanol
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H22OS |
| Molecular Weight | 190.13913 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 190.13913 Da |
| Heavy Atoms | 12 |
| Complexity | 107.0 |
| SMILES | CCCCC(CSC(C)(C)C)O |
| InChIKey | SQIWPOAQTBJFLG-UHFFFAOYSA-N |
Chemical Property Profile of 2-Hexanol, 1-tert-butylthio-
Property Insights of 2-Hexanol, 1-tert-butylthio-
The XLogP value of 3.0 indicates that 2-Hexanol, 1-tert-butylthio- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.5 Ų, 2-Hexanol, 1-tert-butylthio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexanol, 1-tert-butylthio- 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
What is the CAS number of 2-Hexanol, 1-tert-butylthio-?
The CAS number of 2-Hexanol, 1-tert-butylthio- is 152517-47-0.
What is the molecular formula of 2-Hexanol, 1-tert-butylthio-?
The molecular formula of 2-Hexanol, 1-tert-butylthio- is C10H22OS.
What is the molecular weight of 2-Hexanol, 1-tert-butylthio-?
The molecular weight of 2-Hexanol, 1-tert-butylthio- is 190.13913 g/mol.
Where can I buy 2-Hexanol, 1-tert-butylthio-?
You can request a quote for 2-Hexanol, 1-tert-butylthio- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Hexanol, 1-tert-butylthio-?
Yes, CoreyChem provides custom synthesis services for 2-Hexanol, 1-tert-butylthio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.