2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione
TL;DR: 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione (CAS 15116-12-8) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione
Also Known As: 2-methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione, p-Benzoquinone, 2-methoxy-6-(2-methylbutyl)-, 2-Methoxy-6-(2-methylbutyl)-p-benzoquinone, 2-Methoxy-6-(2-methylbutyl)benzo-1,4-quinone #, 2-Methoxy-6-(2-methylbutyl)-2,5-cyclohexadiene-1,4-dione
Technical Specifications
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.10994 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.10994 Da |
| Heavy Atoms | 15 |
| Complexity | 337.0 |
| SMILES | CCC(C)CC1=CC(=O)C=C(C1=O)OC |
| InChIKey | KYHMEFMCHSPWKN-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione
Property Insights of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione has 0 hydrogen bond donor(s) and 3 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-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione?
The CAS number of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione is 15116-12-8.
What is the molecular formula of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione is C12H16O3.
What is the molecular weight of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione is 208.10994 g/mol.
Where can I buy 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione?
Yes, CoreyChem provides custom synthesis services for 2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.