Sodium 4-Hydroxy-2-Methyl-5-Propan-2-Ylbenzoate
[CAS# 1014-52-4]

Identification

• Name: Sodium 4-Hydroxy-2-Methyl-5-Propan-2-Ylbenzoate
• Synonyms: Sodium 4-Hydroxy-5-Isopropyl-2-Methyl-Benzoate; Sodium 4-Hydroxy-5-Isopropyl-2-Methylbenzoate; Sodium 4-Hydroxy-2-Methyl-5-Propan-2-Yl-Benzoate
• Molecular Formula: C₁₁H₁₃NaO₃
• Molecular Weight: 216.21
• CAS Registry Number: 1014-52-4
• SMILES: C1=C(C(=CC(=C1C(C)C)O)C)C([O-])=O.[Na+]
• InChI: 1S/C11H14O3.Na/c1-6(2)8-5-9(11(13)14)7(3)4-10(8)12;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1
• InChIKey: NEWGTAXNYDMBSR-UHFFFAOYSA-M

Properties

• Boiling point: 344.1°C at 760 mmHg (Cal.)
• Flash point: 176.1°C (Cal.)