4,4-Dimethyl-1,1'-Bi(Cyclohexane)-1',3'-Diene-2,6-Dione
[CAS# 54965-48-9]

Identification

• Name: 4,4-Dimethyl-1,1'-Bi(Cyclohexane)-1',3'-Diene-2,6-Dione
• Synonyms: 2-(1,3-Cyclohexadien-1-yl)-5,5-dimethyl-1,3-cyclohexanedione #
• Molecular Formula: C₁₄H₁₈O₂
• Molecular Weight: 218.29
• CAS Registry Number: 54965-48-9
• SMILES: O=C1C(C(=O)CC(C)(C)C1)\C2=C\C=C/CC2
• InChI: 1S/C14H18O2/c1-14(2)8-11(15)13(12(16)9-14)10-6-4-3-5-7-10/h3-4,6,13H,5,7-9H2,1-2H3
• InChIKey: PXMNXHKOWUDRHE-UHFFFAOYSA-N

Properties

• Density: 1.078g/cm³ (Cal.)
• Boiling point: 353.298°C at 760 mmHg (Cal.)
• Flash point: 132.559°C (Cal.)