1-tert-Butyl-3-ethyl-5-methylbenzene
[CAS# 6630-01-9]

Identification

• Name: 1-tert-Butyl-3-ethyl-5-methylbenzene
• Synonyms: 1-Tert-Butyl-3-Ethyl-5-Methyl-Benzene; Nsc60003; 1-(Tert-Butyl)-3-Ethyl-5-Methylbenzene
• Molecular Formula: C₁₃H₂₀
• Molecular Weight: 176.30
• CAS Registry Number: 6630-01-9
• SMILES: C1=C(C=C(C=C1C(C)(C)C)C)CC
• InChI: 1S/C13H20/c1-6-11-7-10(2)8-12(9-11)13(3,4)5/h7-9H,6H2,1-5H3
• InChIKey: URDKTSKLGNWKDB-UHFFFAOYSA-N

Properties

• Density: 0.859g/cm³ (Cal.)
• Boiling point: 221.04°C at 760 mmHg (Cal.)
• Flash point: 79.908°C (Cal.)