1-(4-Methoxyphenyl)-2,2-dimethyl-1-butanone
[CAS# 898765-08-7]

Identification

• Name: 1-(4-Methoxyphenyl)-2,2-dimethyl-1-butanone
• Synonyms: 2,2-Dimethyl-4'-methoxybutyrophenone; MFCD03841121
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 898765-08-7
• SMILES: COc1ccc(cc1)C(=O)C(C)(C)CC
• InChI: 1S/C13H18O2/c1-5-13(2,3)12(14)10-6-8-11(15-4)9-7-10/h6-9H,5H2,1-4H3
• InChIKey: LPCBHBHTRKGRDZ-UHFFFAOYSA-N

Properties

• Density: 0.977g/cm³ (Cal.)
• Boiling point: 307.836°C at 760 mmHg (Cal.)
• Flash point: 125.998°C (Cal.)
• Refractive index: 1.494 (Cal.)

Safety Data

• Safety Description: IRRITANT, FLAMMABLE