12-Keto-9(2)-octadecen-11-olide
TL;DR: 12-Keto-9(2)-octadecen-11-olide (CAS 114416-54-5) is a chemical compound with molecular formula C18H30O3 and molecular weight 294.21948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(10Z)-12-heptanoyl-1-oxacyclododec-10-en-2-one
Also Known As: 12-Koo, 12-Keto-9(2)-octadecen-11-olide, (10Z)-12-heptanoyl-1-oxacyclododec-10-en-2-one, (9z)-12-oxooctadec-9-en-11-olide
Technical Specifications
| Molecular Formula | C18H30O3 |
| Molecular Weight | 294.21948 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.21948 Da |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
| SMILES | CCCCCCC(=O)C1/C=C\CCCCCCCC(=O)O1 |
| InChIKey | TXHNLEIEJZFRRG-KAMYIIQDSA-N |
Chemical Property Profile of 12-Keto-9(2)-octadecen-11-olide
Property Insights of 12-Keto-9(2)-octadecen-11-olide
The XLogP value of 5.7 indicates that 12-Keto-9(2)-octadecen-11-olide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 12-Keto-9(2)-octadecen-11-olide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-Keto-9(2)-octadecen-11-olide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 12-Keto-9(2)-octadecen-11-olide?
The CAS number of 12-Keto-9(2)-octadecen-11-olide is 114416-54-5.
What is the molecular formula of 12-Keto-9(2)-octadecen-11-olide?
The molecular formula of 12-Keto-9(2)-octadecen-11-olide is C18H30O3.
What is the molecular weight of 12-Keto-9(2)-octadecen-11-olide?
The molecular weight of 12-Keto-9(2)-octadecen-11-olide is 294.21948 g/mol.
Where can I buy 12-Keto-9(2)-octadecen-11-olide?
You can request a quote for 12-Keto-9(2)-octadecen-11-olide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 12-Keto-9(2)-octadecen-11-olide?
Yes, CoreyChem provides custom synthesis services for 12-Keto-9(2)-octadecen-11-olide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.