alpha,alpha,4-Trimethylphenethyl Acetate
[CAS# 71617-15-7]

Identification

• Name: alpha,alpha,4-Trimethylphenethyl Acetate
• Synonyms: [1,1-Dimethyl-2-(4-Methylphenyl)Ethyl] Acetate; Acetic Acid [1,1-Dimethyl-2-(4-Methylphenyl)Ethyl] Ester; [2-Methyl-1-(4-Methylphenyl)Propan-2-Yl] Ethanoate
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 71617-15-7
• EINECS: 275-707-2
• SMILES: C1=CC(=CC=C1CC(C)(C)OC(C)=O)C
• InChI: 1S/C13H18O2/c1-10-5-7-12(8-6-10)9-13(3,4)15-11(2)14/h5-8H,9H2,1-4H3
• InChIKey: ZZRMFTYRQORIEE-UHFFFAOYSA-N

Properties

• Density: 0.991g/cm³ (Cal.)
• Boiling point: 278.58°C at 760 mmHg (Cal.)
• Flash point: 105.755°C (Cal.)