4,6-Nonanedione
TL;DR: 4,6-Nonanedione (CAS 14090-88-1) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nonane-4,6-dione
Also Known As: Nonane-4,6-dione, 4,6-NONANEDIONE, 4,6-dioxononane, DIBUTYRYLMETHANE, 1,7-Dimethylheptane-3,5-dione
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H16O2 |
| Molecular Weight | 156.11504 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 156.11504 Da |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
| SMILES | CCCC(=O)CC(=O)CCC |
| InChIKey | ZDYWPVCQPUPOJV-UHFFFAOYSA-N |
Chemical Property Profile of 4,6-Nonanedione
Property Insights of 4,6-Nonanedione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Nonanedione. With a topological polar surface area (TPSA) of 34.1 Ų, 4,6-Nonanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Nonanedione has 0 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 4,6-Nonanedione?
The CAS number of 4,6-Nonanedione is 14090-88-1.
What is the molecular formula of 4,6-Nonanedione?
The molecular formula of 4,6-Nonanedione is C9H16O2.
What is the molecular weight of 4,6-Nonanedione?
The molecular weight of 4,6-Nonanedione is 156.11504 g/mol.
Where can I buy 4,6-Nonanedione?
You can request a quote for 4,6-Nonanedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,6-Nonanedione?
Yes, CoreyChem provides custom synthesis services for 4,6-Nonanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.