Oct-6-enal
TL;DR: Oct-6-enal (CAS 63826-25-5) is a chemical compound with molecular formula C8H14O and molecular weight 126.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
oct-6-enal
Also Known As: 6-Octenal, OCT-6-ENAL, oct-2-en-8-one, (Z)-Oct-6-enal, (E)-6-octen-1-al
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14O |
| Molecular Weight | 126.10446 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 126.10446 Da |
| Heavy Atoms | 9 |
| Complexity | 84.0 |
| SMILES | CC=CCCCCC=O |
| InChIKey | KVNBGNGISDIZRP-UHFFFAOYSA-N |
Chemical Property Profile of Oct-6-enal
Property Insights of Oct-6-enal
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oct-6-enal. With a topological polar surface area (TPSA) of 17.1 Ų, Oct-6-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oct-6-enal 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 Oct-6-enal?
The CAS number of Oct-6-enal is 63826-25-5.
What is the molecular formula of Oct-6-enal?
The molecular formula of Oct-6-enal is C8H14O.
What is the molecular weight of Oct-6-enal?
The molecular weight of Oct-6-enal is 126.10446 g/mol.
Where can I buy Oct-6-enal?
You can request a quote for Oct-6-enal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oct-6-enal?
Yes, CoreyChem provides custom synthesis services for Oct-6-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.