(3E)-3-Methyl-4-(2,5,6-trimethyl-3-cyclohexen-1-yl)-3-buten-2-one
[CAS# 801222-62-8]

Identification

• Name: (3E)-3-Methyl-4-(2,5,6-trimethyl-3-cyclohexen-1-yl)-3-buten-2-one
• Synonyms: (E)-3-methyl-4-(2,5,6-trimethylcyclohex-3-en-1-yl)but-3-en-2-one
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.32
• CAS Registry Number: 801222-62-8
• SMILES: CC1C=CC(C(C1C)/C=C(\C)/C(=O)C)C
• InChI: 1S/C14H22O/c1-9-6-7-10(2)14(12(9)4)8-11(3)13(5)15/h6-10,12,14H,1-5H3/b11-8+
• InChIKey: GYFMVOYEEHYBMW-DHZHZOJOSA-N

Properties

• Density: 0.9±0.1g/cm³ (Cal.)
• Boiling point: 290.4±19.0°C at 760 mmHg (Cal.)
• Flash point: 124.9±14.7°C (Cal.)
• Refractive index: 1.5 (Cal.)