Sodium Isononanoate
[CAS# 84501-72-4]

Identification

• Name: Sodium Isononanoate
• Synonyms: Sodium 7-Methylcaprylate; Isononanoic Acid, Sodium Salt
• Molecular Formula: C₉H₁₇NaO₂
• Molecular Weight: 180.22
• CAS Registry Number: 84501-72-4
• EINECS: 282-992-7
• SMILES: C(C([O-])=O)CCCCC(C)C.[Na+]
• InChI: 1S/C9H18O2.Na/c1-8(2)6-4-3-5-7-9(10)11;/h8H,3-7H2,1-2H3,(H,10,11);/q;+1/p-1
• InChIKey: TVLQCQIKBJXIQX-UHFFFAOYSA-M

Properties

• Boiling point: 253.4°C at 760 mmHg (Cal.)
• Flash point: 129.7°C (Cal.)