1,3,3-Trimethyl-3-(p-Tolyl)Propyl Acetate
[CAS# 84681-85-6]

Identification

• Name: 1,3,3-Trimethyl-3-(p-Tolyl)Propyl Acetate
• Synonyms: [1,3-Dimethyl-3-(4-Methylphenyl)Butyl] Acetate; Acetic Acid [1,3-Dimethyl-3-(4-Methylphenyl)Butyl] Ester; [4-Methyl-4-(4-Methylphenyl)Pentan-2-Yl] Ethanoate
• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.34
• CAS Registry Number: 84681-85-6
• EINECS: 283-545-9
• SMILES: C1=C(C(CC(OC(=O)C)C)(C)C)C=CC(=C1)C
• InChI: 1S/C15H22O2/c1-11-6-8-14(9-7-11)15(4,5)10-12(2)17-13(3)16/h6-9,12H,10H2,1-5H3
• InChIKey: BMHPLNQKERZLCS-UHFFFAOYSA-N

Properties

• Density: 0.967g/cm³ (Cal.)
• Boiling point: 316.285°C at 760 mmHg (Cal.)
• Flash point: 110.951°C (Cal.)