2,6-Dipropan-2-Ylcyclohexa-2,5-Diene-1,4-Dione
[CAS# 1988-11-0]

Identification

• Classification: Analytical chemistry >> Standard >> Pharmacopoeia standards and magazine standards
• Name: 2,6-Dipropan-2-Ylcyclohexa-2,5-Diene-1,4-Dione
• Synonyms: 2,6-Diisopropyl-1,4-Benzoquinone; 2,6-Diisopropyl-P-Benzoquinone; 2,5-Cyclohexadiene-1,4-Dione, 2,6-Bis(1-Methylethyl)-
• Molecular Formula: C₁₂H₁₆O₂
• Molecular Weight: 192.26
• CAS Registry Number: 1988-11-0
• SMILES: CC(C1=CC(=O)C=C(C1=O)C(C)C)C
• InChI: 1S/C12H16O2/c1-7(2)10-5-9(13)6-11(8(3)4)12(10)14/h5-8H,1-4H3
• InChIKey: DDXYWFGBQZICBD-UHFFFAOYSA-N

Properties

• Density: 1.032g/cm³ (Cal.)
• Boiling point: 262.924°C at 760 mmHg (Cal.)
• Flash point: 97.185°C (Cal.)

References

• (1): Belinda Heyne, Stephan Kohnen, Daniel Brault, Ange Mouithys-Mickalad, Francis Tfibel, Pol Hans, Marie-Pierre Fontaine-Aupart and Maryse Hoebeke. Investigation of singlet oxygen reactivity towards propofol, Photochem. Photobiol. Sci., 2003, 2, 939.