2-Nonanone
TL;DR: 2-Nonanone (CAS 821-55-6) is a chemical compound with molecular formula C9H18O and molecular weight 142.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nonan-2-one
Also Known As: 2-NONANONE, Nonan-2-one, Heptyl methyl ketone, Methyl heptyl ketone, beta-Nonanone
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H18O |
| Molecular Weight | 142.13577 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 142.13577 Da |
| Heavy Atoms | 10 |
| Complexity | 86.0 |
| Melting Point | -5.8 °F (USCG, 1999) |
| Boiling Point | 377.6 °F at 743 mmHg (USCG, 1999) |
| Density | 0.832 (USCG, 1999) - Less dense than water; will float |
| Flash Point | 148 °F (USCG, 1999) |
| Vapor Pressure | 1.6 mmHg (USCG, 1999) |
| Refractive Index | 1.418-1.423 |
| Solubility | 0.371 mg/mL at 25 °C |
| SMILES | CCCCCCCC(=O)C |
| InChIKey | VKCYHJWLYTUGCC-UHFFFAOYSA-N |
Chemical Property Profile of 2-Nonanone
Property Insights of 2-Nonanone
The XLogP value of 3.1 indicates that 2-Nonanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Nonanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Nonanone 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 2-Nonanone?
The CAS number of 2-Nonanone is 821-55-6.
What is the molecular formula of 2-Nonanone?
The molecular formula of 2-Nonanone is C9H18O.
What is the molecular weight of 2-Nonanone?
The molecular weight of 2-Nonanone is 142.13577 g/mol.
Where can I buy 2-Nonanone?
You can request a quote for 2-Nonanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Nonanone?
Yes, CoreyChem provides custom synthesis services for 2-Nonanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.