4,6-Bis(2-Methyl-2-Propanyl)-3-Nitro-1,2-Benzoquinone
[CAS# 24457-00-9]

Identification

• Name: 4,6-Bis(2-Methyl-2-Propanyl)-3-Nitro-1,2-Benzoquinone
• Synonyms: 4,6-bis(tert-butyl)-3-nitrocyclohexa-3,5-diene-1,2-dione; 4,6-Ditert-butyl-3-nitrobenzo-1,2-quinone #
• Molecular Formula: C₁₄H₁₉NO₄
• Molecular Weight: 265.30
• CAS Registry Number: 24457-00-9
• SMILES: O=C1/C(=C\C(=C(\[N+]([O-])=O)C1=O)C(C)(C)C)C(C)(C)C
• InChI: 1S/C14H19NO4/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15(18)19/h7H,1-6H3
• InChIKey: MXGLSZOKCUOVNO-UHFFFAOYSA-N

Properties

• Density: 1.134g/cm³ (Cal.)
• Boiling point: 343.697°C at 760 mmHg (Cal.)
• Flash point: 139.616°C (Cal.)
• Refractive index: 1.512 (Cal.)