alpha-Phenoxybutyric acid sodium salt
[CAS# 100700-35-4]

Identification

• Name: alpha-Phenoxybutyric acid sodium salt
• Synonyms: Sodium 2-Phenoxybutyrate; 2-Phenoxybutyric Acid Sodium Salt; Butyric Acid, 2-Phenoxy-, Sodium Salt
• Molecular Formula: C₁₀H₁₁NaO₃
• Molecular Weight: 202.18
• CAS Registry Number: 100700-35-4
• SMILES: C1=C(OC(C([O-])=O)CC)C=CC=C1.[Na+]
• InChI: 1S/C10H12O3.Na/c1-2-9(10(11)12)13-8-6-4-3-5-7-8;/h3-7,9H,2H2,1H3,(H,11,12);/q;+1/p-1
• InChIKey: OWCQJTQGZJVWGI-UHFFFAOYSA-M

Properties

• Boiling point: 258°C at 760 mmHg (Cal.)
• Flash point: 115.3°C (Cal.)