4-(1,1-Dimethylethyl)-2,3,6-Trimethylphenol
[CAS# 70766-53-9]

Identification

• Name: 4-(1,1-Dimethylethyl)-2,3,6-Trimethylphenol
• Synonyms: 4-Tert-Butyl-2,3,6-Trimethyl-Phenol; 2,3,6-Trimethyl-4-Tert-Butylphenol; Phenol, 4-(1,1-Dimethylethyl)-2,3,6-Trimethyl-
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 70766-53-9
• SMILES: C1=C(C(=C(C(=C1C(C)(C)C)C)C)O)C
• InChI: 1S/C13H20O/c1-8-7-11(13(4,5)6)9(2)10(3)12(8)14/h7,14H,1-6H3
• InChIKey: RYOYKAIHYPDPGL-UHFFFAOYSA-N

Properties

• Density: 0.946g/cm³ (Cal.)
• Boiling point: 276.361°C at 760 mmHg (Cal.)
• Flash point: 124.238°C (Cal.)