TL;DR: 12-Keto-9(2)-octadecen-13-olide (CAS 1144161-05-6) 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)-14-pentyl-1-oxacyclotetradec-10-ene-2,13-dione
Also Known As: 12-KO13O, 12-Keto-9(2)-octadecen-13-olide, (10Z)-14-pentyl-1-oxacyclotetradec-10-ene-2,13-dione, (2R)-2-hydroxy-1,2-dipyridin-2-ylethanone, (2S)-2-hydroxy-1,2-dipyridin-2-ylethanone
| Molecular Formula | C18H30O3 |
| Molecular Weight | 294.21948 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.21948 Da |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
| SMILES | CCCCCC1C(=O)C/C=C\CCCCCCCC(=O)O1 |
| InChIKey | MANKLCWXYICFDJ-FLIBITNWSA-N |
The XLogP value of 5.6 indicates that 12-Keto-9(2)-octadecen-13-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-13-olide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-Keto-9(2)-octadecen-13-olide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 12-Keto-9(2)-octadecen-13-olide is 1144161-05-6.
The molecular formula of 12-Keto-9(2)-octadecen-13-olide is C18H30O3.
The molecular weight of 12-Keto-9(2)-octadecen-13-olide is 294.21948 g/mol.
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