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CAS | 1117-52-8 |
Structure | |
Description | (5E,9E)-6,10,14-Trimethylpentadeca-5,9,13-trien-2-one is a marine derived natural products found in Sargassum micracanthum. |
Synonyms | (E,E)-6,10,14-Trimethylpentadeca-5,9,13-trien-2-one |
IUPAC Name | (5E,9E)-6,10,14-Trimethylpentadeca-5,9,13-trien-2-one |
Molecular Weight | 262.4 |
Canonical SMILES | CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C |
InChI | InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+ |
InChI Key | LTUMRKDLVGQMJU-IUBLYSDUSA-N |
Boiling Point | 147-148 °C |
Purity | 95%+ |
Density | 0.88 g/mL at 20 °C (lit.) |
Solubility | Soluble in water and oils |
Complexity | 352 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Exact Mass | 262.229665576 |
Heavy Atom Count | 19 |
Isomeric SMILES | CC(=CCC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)C |
Monoisotopic Mass | 262.229665576 |
Physical State | Powder |
Refractive Index | n20/D 1.481 |
Storage Conditions | Powder: -20°C for 3 years In solvent: -80°C for 2 years |
Topological Polar Surface Area | 17.1 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.