Hexadeca-1,11-dien-3-one
TL;DR: Hexadeca-1,11-dien-3-one (CAS 126779-21-3) is a chemical compound with molecular formula C16H28O and molecular weight 236.21402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
hexadeca-1,11-dien-3-one
Also Known As: Hexadeca-1,11-dien-3-one, 1,11-Hexadecadien-3-one, 1,11-Hexadecadien-3-one,(Z)- (9CI)
Technical Specifications
| Molecular Formula | C16H28O |
| Molecular Weight | 236.21402 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 236.21402 Da |
| Heavy Atoms | 17 |
| Complexity | 216.0 |
| SMILES | CCCCC=CCCCCCCCC(=O)C=C |
| InChIKey | VUAYOUHRLLXCSH-UHFFFAOYSA-N |
Chemical Property Profile of Hexadeca-1,11-dien-3-one
Property Insights of Hexadeca-1,11-dien-3-one
The XLogP value of 5.8 indicates that Hexadeca-1,11-dien-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Hexadeca-1,11-dien-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadeca-1,11-dien-3-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Hexadeca-1,11-dien-3-one?
The CAS number of Hexadeca-1,11-dien-3-one is 126779-21-3.
What is the molecular formula of Hexadeca-1,11-dien-3-one?
The molecular formula of Hexadeca-1,11-dien-3-one is C16H28O.
What is the molecular weight of Hexadeca-1,11-dien-3-one?
The molecular weight of Hexadeca-1,11-dien-3-one is 236.21402 g/mol.
Where can I buy Hexadeca-1,11-dien-3-one?
You can request a quote for Hexadeca-1,11-dien-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hexadeca-1,11-dien-3-one?
Yes, CoreyChem provides custom synthesis services for Hexadeca-1,11-dien-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.