Sodium 7,7-Dimethyloctanoate
[CAS# 31548-27-3]

Identification

• Name: Sodium 7,7-Dimethyloctanoate
• Synonyms: Sodium 7,7-Dimethylcaprylate; Neodecanoic Acid, Sodium Salt
• Molecular Formula: C₁₀H₁₉NaO₂
• Molecular Weight: 194.25
• CAS Registry Number: 31548-27-3
• EINECS: 250-692-5
• SMILES: C(C(C)(C)C)CCCCC([O-])=O.[Na+]
• InChI: 1S/C10H20O2.Na/c1-10(2,3)8-6-4-5-7-9(11)12;/h4-8H2,1-3H3,(H,11,12);/q;+1/p-1
• InChIKey: CASCCINXYVTVRI-UHFFFAOYSA-M

Properties

• Boiling point: 265.6°C at 760 mmHg (Cal.)
• Flash point: 121.3°C (Cal.)