(6E)-6-pentylideneoxan-2-one
TL;DR: (6E)-6-pentylideneoxan-2-one (CAS 163843-08-1) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6E)-6-pentylideneoxan-2-one
Also Known As: 6-pentylideneoxan-2-one, (6E)-6-pentylideneoxan-2-one
Technical Specifications
| Molecular Formula | C10H16O2 |
| Molecular Weight | 168.11504 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.11504 Da |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
| SMILES | CCCC/C=C/1\CCCC(=O)O1 |
| InChIKey | GRLBVEQTONZPAM-RMKNXTFCSA-N |
Chemical Property Profile of (6E)-6-pentylideneoxan-2-one
Property Insights of (6E)-6-pentylideneoxan-2-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6E)-6-pentylideneoxan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, (6E)-6-pentylideneoxan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (6E)-6-pentylideneoxan-2-one 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 (6E)-6-pentylideneoxan-2-one?
The CAS number of (6E)-6-pentylideneoxan-2-one is 163843-08-1.
What is the molecular formula of (6E)-6-pentylideneoxan-2-one?
The molecular formula of (6E)-6-pentylideneoxan-2-one is C10H16O2.
What is the molecular weight of (6E)-6-pentylideneoxan-2-one?
The molecular weight of (6E)-6-pentylideneoxan-2-one is 168.11504 g/mol.
Where can I buy (6E)-6-pentylideneoxan-2-one?
You can request a quote for (6E)-6-pentylideneoxan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (6E)-6-pentylideneoxan-2-one?
Yes, CoreyChem provides custom synthesis services for (6E)-6-pentylideneoxan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.