1,3-Cyclohexadiene-1,4-Dicarboxylic Acid
[CAS# 1659-68-3]

Identification

• Name: 1,3-Cyclohexadiene-1,4-Dicarboxylic Acid
• Molecular Formula: C₈H₈O₄
• Molecular Weight: 168.15
• CAS Registry Number: 1659-68-3
• SMILES: O=C(O)C=1CC/C(=C\C=1)C(O)=O
• InChI: 1S/C8H8O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-2H,3-4H2,(H,9,10)(H,11,12)
• InChIKey: BQYOGZXCESFTRX-UHFFFAOYSA-N

Properties

• Density: 1.481g/cm³ (Cal.)
• Boiling point: 346.22°C at 760 mmHg (Cal.)
• Flash point: 177.385°C (Cal.)
• Refractive index: 1.605 (Cal.)