4-Isopropyl-1-Methoxy-1,3,5-Cycloheptatriene
[CAS# 126893-59-2]

Identification

• Name: 4-Isopropyl-1-Methoxy-1,3,5-Cycloheptatriene
• Synonyms: 4-isopropyl-1-methoxycyclohepta-1,3,5-triene
• Molecular Formula: C₁₁H₁₆O
• Molecular Weight: 164.24
• CAS Registry Number: 126893-59-2
• SMILES: CC(C)C1=CC=C(CC=C1)OC
• InChI: 1S/C11H16O/c1-9(2)10-5-4-6-11(12-3)8-7-10/h4-5,7-9H,6H2,1-3H3
• InChIKey: GFVVNOIMQXDIJG-UHFFFAOYSA-N

Properties

• Density: 0.921g/cm³ (Cal.)
• Boiling point: 251.179°C at 760 mmHg (Cal.)
• Flash point: 99.429°C (Cal.)
• Refractive index: 1.494 (Cal.)