5-Methyl-2-(Isopropyl)Phenyl Isovalerate
[CAS# 69844-33-3]

Identification

• Name: 5-Methyl-2-(Isopropyl)Phenyl Isovalerate
• Synonyms: (2-Isopropyl-5-Methyl-Phenyl) 3-Methylbutanoate; 3-Methylbutanoic Acid (2-Isopropyl-5-Methylphenyl) Ester; 3-Methylbutyric Acid (2-Isopropyl-5-Methyl-Phenyl) Ester
• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.34
• CAS Registry Number: 69844-33-3
• EINECS: 274-146-0
• SMILES: C1=C(C=CC(=C1OC(=O)CC(C)C)C(C)C)C
• InChI: 1S/C15H22O2/c1-10(2)8-15(16)17-14-9-12(5)6-7-13(14)11(3)4/h6-7,9-11H,8H2,1-5H3
• InChIKey: NZIACPHCVAFJBR-UHFFFAOYSA-N

Properties

• Density: 0.963g/cm³ (Cal.)
• Boiling point: 294.87°C at 760 mmHg (Cal.)
• Flash point: 106.683°C (Cal.)