2-(3-Oxobutyl)cyclopentanone
TL;DR: 2-(3-Oxobutyl)cyclopentanone (CAS 1489-27-6) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-oxobutyl)cyclopentan-1-one
Also Known As: 2-(3-Oxobutyl)cyclopentanone, 2-(3-oxobutyl)cyclopentan-1-one, 2-(3'-Oxo-butyl)-cyclopentanone, 2-(3-Oxobutyl)cyclopentanone #, 2-(3-oxo-butyl)-cyclopentan-1-one
Technical Specifications
| Molecular Formula | C9H14O2 |
| Molecular Weight | 154.09938 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.09938 Da |
| Heavy Atoms | 11 |
| Complexity | 172.0 |
| SMILES | CC(=O)CCC1CCCC1=O |
| InChIKey | UQNURBRPTHTGEH-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Oxobutyl)cyclopentanone
Property Insights of 2-(3-Oxobutyl)cyclopentanone
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Oxobutyl)cyclopentanone. With a topological polar surface area (TPSA) of 34.1 Ų, 2-(3-Oxobutyl)cyclopentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Oxobutyl)cyclopentanone 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-(3-Oxobutyl)cyclopentanone?
The CAS number of 2-(3-Oxobutyl)cyclopentanone is 1489-27-6.
What is the molecular formula of 2-(3-Oxobutyl)cyclopentanone?
The molecular formula of 2-(3-Oxobutyl)cyclopentanone is C9H14O2.
What is the molecular weight of 2-(3-Oxobutyl)cyclopentanone?
The molecular weight of 2-(3-Oxobutyl)cyclopentanone is 154.09938 g/mol.
Where can I buy 2-(3-Oxobutyl)cyclopentanone?
You can request a quote for 2-(3-Oxobutyl)cyclopentanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Oxobutyl)cyclopentanone?
Yes, CoreyChem provides custom synthesis services for 2-(3-Oxobutyl)cyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.