3-(m-tolylmethyl)pentane-2,4-dione
[CAS# 791809-53-5]

Identification

• Name: 3-(m-tolylmethyl)pentane-2,4-dione
• Synonyms: 3-(3-methylbenzyl)pentane-2,4-dione
• Molecular Formula: C₁₃H₁₆O₂
• Molecular Weight: 204.26
• CAS Registry Number: 791809-53-5
• SMILES: CC(=O)C(Cc1cccc(C)c1)C(C)=O
• InChI: 1S/C13H16O2/c1-9-5-4-6-12(7-9)8-13(10(2)14)11(3)15/h4-7,13H,8H2,1-3H3
• InChIKey: ZGXMXUJJZATMFQ-UHFFFAOYSA-N

Properties

• Density: 1.026g/cm³ (Cal.)
• Boiling point: 303.834°C at 760 mmHg (Cal.)
• Flash point: 113.54°C (Cal.)
• Refractive index: 1.506 (Cal.)