1,3,5-Tris(2,2-Dimethylpropyl)-2,4-Dimethyl-6-Nitrobenzene
[CAS# 40572-22-3]

Identification

• Name: 1,3,5-Tris(2,2-Dimethylpropyl)-2,4-Dimethyl-6-Nitrobenzene
• Synonyms: 1,3-Dimethyl-2,4,6-trineopentyl-5-nitrobenzene #
• Molecular Formula: C₂₃H₃₉NO₂
• Molecular Weight: 361.56
• CAS Registry Number: 40572-22-3
• SMILES: [O-][N+](=O)c1c(c(c(c(c1CC(C)(C)C)C)CC(C)(C)C)C)CC(C)(C)C
• InChI: 1S/C23H39NO2/c1-15-17(12-21(3,4)5)16(2)19(14-23(9,10)11)20(24(25)26)18(15)13-22(6,7)8/h12-14H2,1-11H3
• InChIKey: FUGNXSGCLVOGSR-UHFFFAOYSA-N

Properties

• Density: 0.949g/cm³ (Cal.)
• Boiling point: 439.999°C at 760 mmHg (Cal.)
• Flash point: 164.884°C (Cal.)