1-Methoxy-5-methylhexane-2,4-dione
TL;DR: 1-Methoxy-5-methylhexane-2,4-dione (CAS 144712-26-5) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-5-methylhexane-2,4-dione
Also Known As: 1-methoxy-5-methylhexane-2,4-dione, 2,4-Hexanedione, 1-methoxy-5-methyl-, 1-methoxy-5-methyl-hexane-2,4-dione, 963-982-8
Technical Specifications
| Molecular Formula | C8H14O3 |
| Molecular Weight | 158.0943 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.0943 Da |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
| SMILES | CC(C)C(=O)CC(=O)COC |
| InChIKey | TVRWWTMMBGBRFG-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methoxy-5-methylhexane-2,4-dione
Property Insights of 1-Methoxy-5-methylhexane-2,4-dione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxy-5-methylhexane-2,4-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 1-Methoxy-5-methylhexane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxy-5-methylhexane-2,4-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 1-Methoxy-5-methylhexane-2,4-dione?
The CAS number of 1-Methoxy-5-methylhexane-2,4-dione is 144712-26-5.
What is the molecular formula of 1-Methoxy-5-methylhexane-2,4-dione?
The molecular formula of 1-Methoxy-5-methylhexane-2,4-dione is C8H14O3.
What is the molecular weight of 1-Methoxy-5-methylhexane-2,4-dione?
The molecular weight of 1-Methoxy-5-methylhexane-2,4-dione is 158.0943 g/mol.
Where can I buy 1-Methoxy-5-methylhexane-2,4-dione?
You can request a quote for 1-Methoxy-5-methylhexane-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methoxy-5-methylhexane-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 1-Methoxy-5-methylhexane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.