3-Methylbutyl 2-Methylheptanoate
[CAS# 94133-55-8]

Identification

• Name: 3-Methylbutyl 2-Methylheptanoate
• Synonyms: Isopentyl 2-Methylheptanoate; 2-Methylheptanoic Acid Isopentyl Ester; 2-Methylenanthic Acid Isoamyl Ester
• Molecular Formula: C₁₃H₂₆O₂
• Molecular Weight: 214.35
• CAS Registry Number: 94133-55-8
• EINECS: 302-716-1
• SMILES: C(OC(=O)C(CCCCC)C)CC(C)C
• InChI: 1S/C13H26O2/c1-5-6-7-8-12(4)13(14)15-10-9-11(2)3/h11-12H,5-10H2,1-4H3
• InChIKey: LRFCJZFOGFVMEL-UHFFFAOYSA-N

Properties

• Density: 0.867g/cm³ (Cal.)
• Boiling point: 239.456°C at 760 mmHg (Cal.)
• Flash point: 104.004°C (Cal.)