Hexanoic Acid 3,7-Dimethyl-6-Octen-1-Yl Ester
[CAS 10580-25-3]

Identification

• Name: Hexanoic Acid 3,7-Dimethyl-6-Octen-1-Yl Ester
• Synonyms: Hexanoic Acid 3,7-Dimethyloct-6-Enyl Ester; Hexanoic Acid, 3,7-Dimethyl-6-Octenyl Ester
• Molecular Formula: C₁₆H₃₀O₂
• Molecular Weight: 254.41
• CAS Registry Number: 10580-25-3
• EINECS: 234-175-1
• SMILES: C(CC=C(C)C)C(CCOC(=O)CCCCC)C
• InChI: 1S/C16H30O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,15H,5-8,10-13H2,1-4H3
• InChIKey: KNYRCCKTQMBSFP-UHFFFAOYSA-N

Properties

• Density: 0.878g/cm³ (Cal.)
• Boiling point: 328.328°C at 760 mmHg (Cal.)
• Flash point: 95.121°C (Cal.)