(2E,4E,6E)-7-(4,4,7alpha-Trimethyl-2,5,6,7-Tetrahydro-1-Benzofuran-2-Yl)-3-Methylocta-2,4,6-Trienoic Acid
[CAS# 3012-76-8]

Identification

• Name: (2E,4E,6E)-7-(4,4,7alpha-Trimethyl-2,5,6,7-Tetrahydro-1-Benzofuran-2-Yl)-3-Methylocta-2,4,6-Trienoic Acid
• Synonyms: (2E,4E,6E)-7-(4,4,7A-Trimethyl-2,5,6,7-Tetrahydrobenzofuran-2-Yl)-3-Methyl-Octa-2,4,6-Trienoic Acid; (2E,4E,6E)-7-(4,4,7A-Trimethyl-2,5,6,7-Tetrahydrobenzofuran-2-Yl)-3-Methylocta-2,4,6-Trienoic Acid; (2E,4E,6E)-7-(4,4,7A-Trimethyl-2,5,6,7-Tetrahydro-1-Benzofuran-2-Yl)-3-Methyl-Octa-2,4,6-Trienoic Acid
• Molecular Formula: C₂₀H₂₈O₃
• Molecular Weight: 316.44
• CAS Registry Number: 3012-76-8
• SMILES: CC2(C1=CC(OC1(CCC2)C)C(=C/C=C/C(=C/C(=O)O)C)/C)C
• InChI: 1S/C20H28O3/c1-14(12-18(21)22)8-6-9-15(2)16-13-17-19(3,4)10-7-11-20(17,5)23-16/h6,8-9,12-13,16H,7,10-11H2,1-5H3,(H,21,22)/b8-6+,14-12+,15-9+
• InChIKey: QDOSIDVGVRAXSE-JUPVTLSTSA-N

Properties

• Density: 1.074g/cm³ (Cal.)
• Boiling point: 466.063°C at 760 mmHg (Cal.)
• Flash point: 159.767°C (Cal.)