Methyl 4-(3-Hydroxy-2-Methylpropyl)Benzoate
[CAS# 170955-21-2]

Identification

• Name: Methyl 4-(3-Hydroxy-2-Methylpropyl)Benzoate
• Synonyms: BENZOIC ACID, 4-(3-HYDROXY-2-METHYLPROPYL)-, METHYL ESTER; methyl 4-(3-hydroxy-2-methylpropyl)benzoate
• Molecular Formula: C₁₂H₁₆O₃
• Molecular Weight: 208.25
• CAS Registry Number: 170955-21-2
• SMILES: CC(Cc1ccc(cc1)C(=O)OC)CO
• InChI: 1S/C12H16O3/c1-9(8-13)7-10-3-5-11(6-4-10)12(14)15-2/h3-6,9,13H,7-8H2,1-2H3
• InChIKey: BANBEJVSLPOVCM-UHFFFAOYSA-N

Properties

• Density: 1.09g/cm³ (Cal.)
• Boiling point: 334.05°C at 760 mmHg (Cal.)
• Flash point: 139.294°C (Cal.)
• Refractive index: 1.523 (Cal.)