5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone
TL;DR: 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone (CAS 17369-60-7) is a chemical compound with molecular formula C12H20O and molecular weight 180.15141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-2,3,4,5-tetramethylcyclohex-2-en-1-one
Also Known As: FEMA No. 3061, 5-ethyl-2,3,4,5-tetramethylcyclohex-2-en-1-one, 5-Ethyl-2,3,4,5-tetramethylcyclohexen-1-one, 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one, 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone
Technical Specifications
| Molecular Formula | C12H20O |
| Molecular Weight | 180.15141 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.15141 Da |
| Heavy Atoms | 13 |
| Complexity | 262.0 |
| SMILES | CCC1(CC(=O)C(=C(C1C)C)C)C |
| InChIKey | WVMYETLAAOQTLM-UHFFFAOYSA-N |
Chemical Property Profile of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone
Property Insights of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone. With a topological polar surface area (TPSA) of 17.1 Ų, 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone?
The CAS number of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone is 17369-60-7.
What is the molecular formula of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone?
The molecular formula of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone is C12H20O.
What is the molecular weight of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone?
The molecular weight of 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone is 180.15141 g/mol.
Where can I buy 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone?
You can request a quote for 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone?
Yes, CoreyChem provides custom synthesis services for 5-Ethyl-2,3,4,5-tetramethyl-2-cyclohexenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.