4-Methoxy-2,6-Bis(2-Methyl-2-Propanyl)Phenyl 1-Nitrocyclopropanecarboxylate
[CAS# 104755-90-0]

Identification

• Name: 4-Methoxy-2,6-Bis(2-Methyl-2-Propanyl)Phenyl 1-Nitrocyclopropanecarboxylate
• Synonyms: 1-Nitrocyclopropanecarboxylic acid, 2,6-di-t-butyl-4-methoxy-phenyl ester; 2,6-Ditert-butyl-4-methoxyphenyl 1-nitrocyclopropanecarboxylate #
• Molecular Formula: C₁₉H₂₇NO₅
• Molecular Weight: 349.42
• CAS Registry Number: 104755-90-0
• SMILES: [O-][N+](=O)C2(C(=O)Oc1c(cc(OC)cc1C(C)(C)C)C(C)(C)C)CC2
• InChI: 1S/C19H27NO5/c1-17(2,3)13-10-12(24-7)11-14(18(4,5)6)15(13)25-16(21)19(8-9-19)20(22)23/h10-11H,8-9H2,1-7H3
• InChIKey: BANYMWIJEUJLIY-UHFFFAOYSA-N

Properties

• Density: 1.145g/cm³ (Cal.)
• Boiling point: 441.936°C at 760 mmHg (Cal.)
• Flash point: 156.442°C (Cal.)
• Refractive index: 1.532 (Cal.)