3,3-Dimethyl-5-Oxopentanoic Acid
[CAS# 77514-27-3]

Identification

• Name: 3,3-Dimethyl-5-Oxopentanoic Acid
• Synonyms: 3,3-Dimethyl-5-Oxo-Pentanoic Acid; 5-Keto-3,3-Dimethyl-Valeric Acid; 3,3-Dimethyl-5-Oxovaleric Acid
• Molecular Formula: C₇H₁₂O₃
• Molecular Weight: 144.17
• CAS Registry Number: 77514-27-3
• EINECS: 278-706-5
• SMILES: C(C(CC=O)(C)C)C(=O)O
• InChI: 1S/C7H12O3/c1-7(2,3-4-8)5-6(9)10/h4H,3,5H2,1-2H3,(H,9,10)
• InChIKey: CIBRWFVOWKXEFX-UHFFFAOYSA-N

Properties

• Density: 1.059g/cm³ (Cal.)
• Boiling point: 269.238°C at 760 mmHg (Cal.)
• Flash point: 130.88°C (Cal.)