3-[(2E)-2-Penten-1-Yl]-1,2,4-Cyclopentanetrione
[CAS# 54644-27-8]

Identification

• Name: 3-[(2E)-2-Penten-1-Yl]-1,2,4-Cyclopentanetrione
• Synonyms: 3-[(2E)-2-Pentenyl]-1,2,4-cyclopentanetrione #
• Molecular Formula: C₁₀H₁₂O₃
• Molecular Weight: 180.20
• CAS Registry Number: 54644-27-8
• SMILES: O=C1CC(=O)C(=O)C1C/C=C/CC
• InChI: 1S/C10H12O3/c1-2-3-4-5-7-8(11)6-9(12)10(7)13/h3-4,7H,2,5-6H2,1H3/b4-3+
• InChIKey: CCBOLCQGIIFGHM-ONEGZZNKSA-N

Properties

• Density: 1.134g/cm³ (Cal.)
• Boiling point: 303.018°C at 760 mmHg (Cal.)
• Flash point: 126.751°C (Cal.)