2,7-Octanedione
TL;DR: 2,7-Octanedione (CAS 1626-09-1) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
octane-2,7-dione
Also Known As: octane-2,7-dione, 2,7-OCTANEDIONE, 2,7-octadione, 2,5-Octanedione, Anthracene photodimer
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.09938 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.09938 Da |
| Heavy Atoms | 10 |
| Complexity | 111.0 |
| SMILES | CC(=O)CCCCC(=O)C |
| InChIKey | NZGDDIUIXYFYFO-UHFFFAOYSA-N |
Chemical Property Profile of 2,7-Octanedione
Property Insights of 2,7-Octanedione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Octanedione. With a topological polar surface area (TPSA) of 34.1 Ų, 2,7-Octanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Octanedione 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 2,7-Octanedione?
The CAS number of 2,7-Octanedione is 1626-09-1.
What is the molecular formula of 2,7-Octanedione?
The molecular formula of 2,7-Octanedione is C8H14O2.
What is the molecular weight of 2,7-Octanedione?
The molecular weight of 2,7-Octanedione is 142.09938 g/mol.
Where can I buy 2,7-Octanedione?
You can request a quote for 2,7-Octanedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,7-Octanedione?
Yes, CoreyChem provides custom synthesis services for 2,7-Octanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.