3,3-Dimethyl-1,5-Ditert-Butyl-Bicyclo[3.1.0]Hexan-4-One
[CAS# 19377-95-8]

Identification

• Name: 3,3-Dimethyl-1,5-Ditert-Butyl-Bicyclo[3.1.0]Hexan-4-One
• Synonyms: 1,5-Ditert-Butyl-3,3-Dimethyl-Bicyclo[3.1.0]Hexan-4-One; 1,5-Ditert-Butyl-3,3-Dimethyl-4-Bicyclo[3.1.0]Hexanone; Bicyclo[3.1.0]Hexan-2-One, 1,5-Bis(1,1-Dimethylethyl)-3,3-Dimethyl-
• Molecular Formula: C₁₆H₂₈O
• Molecular Weight: 236.40
• CAS Registry Number: 19377-95-8
• SMILES: CC(C)(C)C12C(C1)(C(C)(C)C)C(C(C2)(C)C)=O
• InChI: 1S/C16H28O/c1-12(2,3)15-9-14(7,8)11(17)16(15,10-15)13(4,5)6/h9-10H2,1-8H3
• InChIKey: BPSOBKPRRBSNAW-UHFFFAOYSA-N

Properties

• Density: 0.967g/cm³ (Cal.)
• Boiling point: 284.838°C at 760 mmHg (Cal.)
• Flash point: 118.546°C (Cal.)