1-[(2E,6E,10E)-3,7,11,15-Tetramethyl-2,6,10,14-Hexadecatetraen-1-Yl]-2-Azepanone
[CAS# 117694-78-7]

Identification

• Name: 1-[(2E,6E,10E)-3,7,11,15-Tetramethyl-2,6,10,14-Hexadecatetraen-1-Yl]-2-Azepanone
• Synonyms: 1-(3,7,11,15-TETRAMETHYL-2,6,10,14-HEXADECATETRAEN-1-YL)-AZACYCLOHEPTAN-2-ONE; N-(3,7,11,15-TETRAMETHYL-2,6,10,14-HEXADECATETRAEN-1-YL)-ε-CAPROLACTAM
• Molecular Formula: C₂₆H₄₃NO
• Molecular Weight: 385.63
• CAS Registry Number: 117694-78-7
• SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CN1CCCCCC1=O)/C)/C)/C)C
• InChI: 1S/C26H43NO/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)19-21-27-20-8-6-7-18-26(27)28/h12,14,16,19H,6-11,13,15,17-18,20-21H2,1-5H3/b23-14+,24-16+,25-19+
• InChIKey: CEMMKPPUZSMGFQ-PHPAXXOYSA-N

Properties

• Density: 0.918g/cm³ (Cal.)
• Boiling point: 517.951°C at 760 mmHg (Cal.)
• Flash point: 208.856°C (Cal.)
• Refractive index: 1.501 (Cal.)