Cyclohexanone, 2-(thioacetyl)-
TL;DR: Cyclohexanone, 2-(thioacetyl)- (CAS 15578-82-2) is a chemical compound with molecular formula C8H12OS and molecular weight 156.06088 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxycyclohex-2-en-1-yl)ethanethione
Also Known As: Cyclohexanone, 2-(thioacetyl)-, 2-Thioacetylcyclohexen-1-ol, Cyclohexanone,2-(thioacetyl), 1-(2-hydroxycyclohex-2-en-1-yl)ethanethione, 1-(2-hydroxy-1-cyclohex-2-enyl)ethanethione
Technical Specifications
| Molecular Formula | C8H12OS |
| Molecular Weight | 156.06088 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.06088 Da |
| Heavy Atoms | 10 |
| Complexity | 172.0 |
| SMILES | CC(=S)C1CCCC=C1O |
| InChIKey | APYYINKRGGMOSK-UHFFFAOYSA-N |
Chemical Property Profile of Cyclohexanone, 2-(thioacetyl)-
Property Insights of Cyclohexanone, 2-(thioacetyl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanone, 2-(thioacetyl)-. With a topological polar surface area (TPSA) of 52.3 Ų, Cyclohexanone, 2-(thioacetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanone, 2-(thioacetyl)- 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 Cyclohexanone, 2-(thioacetyl)-?
The CAS number of Cyclohexanone, 2-(thioacetyl)- is 15578-82-2.
What is the molecular formula of Cyclohexanone, 2-(thioacetyl)-?
The molecular formula of Cyclohexanone, 2-(thioacetyl)- is C8H12OS.
What is the molecular weight of Cyclohexanone, 2-(thioacetyl)-?
The molecular weight of Cyclohexanone, 2-(thioacetyl)- is 156.06088 g/mol.
Where can I buy Cyclohexanone, 2-(thioacetyl)-?
You can request a quote for Cyclohexanone, 2-(thioacetyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclohexanone, 2-(thioacetyl)-?
Yes, CoreyChem provides custom synthesis services for Cyclohexanone, 2-(thioacetyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.