1,3,5,7-Cyclooctatetraene-1-Carboxylic Acid
[CAS# 2411-95-2]

Identification

• Name: 1,3,5,7-Cyclooctatetraene-1-Carboxylic Acid
• Synonyms: (1E,3Z,5Z,7Z)-cycloocta-1,3,5,7-tetraenecarboxylic acid
• Molecular Formula: C₉H₈O₂
• Molecular Weight: 148.16
• CAS Registry Number: 2411-95-2
• SMILES: C1=CC=CC(=CC=C1)C(=O)O
• InChI: 1S/C9H8O2/c10-9(11)8-6-4-2-1-3-5-7-8/h1-7H,(H,10,11)/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6+,8-7+
• InChIKey: JTSWCHSPSNVWLC-NPLFUSBWSA-N

Properties

• Density: 1.182g/cm³ (Cal.)
• Boiling point: 331.187°C at 760 mmHg (Cal.)
• Flash point: 148.431°C (Cal.)
• Refractive index: 1.574 (Cal.)