2,3-Ditert-butylphenol
[CAS# 26746-38-3]

Identification

• Name: 2,3-Ditert-butylphenol
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.33
• CAS Registry Number: 26746-38-3
• SMILES: C1=CC=C(C(=C1C(C)(C)C)C(C)(C)C)O
• InChI: 1S/C14H22O/c1-13(2,3)10-8-7-9-11(15)12(10)14(4,5)6/h7-9,15H,1-6H3
• InChIKey: SKDGWNHUETZZCS-UHFFFAOYSA-N

Properties

• Density: 0.933g/cm³ (Cal.)
• Boiling point: 280.844°C at 760 mmHg (Cal.)
• Flash point: 129.312°C (Cal.)

References

• (1): Tatsuya Fujii, Syuhei Yamaguchi, Shun Hirota and Hideki Masuda. H-atom abstraction reaction for organic substrates via mononuclear copper(ii)-superoxo species as a model for DβM and PHM, Dalton Trans., 2008, 164.