2-[3-Methyl-4-(1-Methylethyl)Phenoxy]-Aceticacid
[CAS# 105401-43-2]

Identification

• Name: 2-[3-Methyl-4-(1-Methylethyl)Phenoxy]-Aceticacid
• Synonyms: 2-(4-Isopropyl-3-Methyl-Phenoxy)Acetate; 2-(4-Isopropyl-3-Methylphenoxy)Acetate; 2-(3-Methyl-4-Propan-2-Yl-Phenoxy)Ethanoate
• Molecular Formula: C₁₂H₁₅O₃
• Molecular Weight: 207.25
• CAS Registry Number: 105401-43-2
• SMILES: C1=C(OCC([O-])=O)C=CC(=C1C)C(C)C
• InChI: 1S/C12H16O3/c1-8(2)11-5-4-10(6-9(11)3)15-7-12(13)14/h4-6,8H,7H2,1-3H3,(H,13,14)/p-1
• InChIKey: KHBZMSZIDSFMDY-UHFFFAOYSA-M

Properties

• Boiling point: 337.542°C at 760 mmHg (Cal.)
• Flash point: 126.569°C (Cal.)