2-Methyl-2-Pentyl-1,3-Benzodioxole
[CAS# 4436-30-0]

Identification

• Name: 2-Methyl-2-Pentyl-1,3-Benzodioxole
• Synonyms: 2-Amyl-2-Methyl-1,3-Benzodioxole; 1,3-Benzodioxole, 2-Methyl-2-Pentyl-; 2-Heptanone, Cyclic O-Phenylene Acetal
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 4436-30-0
• EINECS: 224-647-5
• SMILES: C1=CC2=C(C=C1)OC(O2)(C)CCCCC
• InChI: 1S/C13H18O2/c1-3-4-7-10-13(2)14-11-8-5-6-9-12(11)15-13/h5-6,8-9H,3-4,7,10H2,1-2H3
• InChIKey: PELGNAVQBDNQGI-UHFFFAOYSA-N

Properties

• Density: 1.001g/cm³ (Cal.)
• Boiling point: 265.783°C at 760 mmHg (Cal.)
• Flash point: 120.043°C (Cal.)