Chorismic Acid
[CAS# 617-12-9]

Identification

• Name: Chorismic Acid
• Synonyms: 3-(1-Carboxyethenoxy)-4-Hydroxy-Cyclohexa-1,5-Diene-1-Carboxylic Acid; 3-(1-Carboxyethenoxy)-4-Hydroxy-1-Cyclohexa-1,5-Dienecarboxylic Acid; 4-Hydroxy-3-(3-Hydroxy-3-Oxo-Prop-1-En-2-Yl)Oxy-Cyclohexa-1,5-Diene-1-Carboxylic Acid
• Molecular Formula: C₁₀H₁₀O₆
• Molecular Weight: 226.19
• CAS Registry Number: 617-12-9
• SMILES: O=C(C1=CC(C(C=C1)O)OC(C(O)=O)=C)O
• InChI: 1S/C10H10O6/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8,11H,1H2,(H,12,13)(H,14,15)
• InChIKey: WTFXTQVDAKGDEY-UHFFFAOYSA-N

Properties

• Density: 1.496g/cm³ (Cal.)
• Boiling point: 556.081°C at 760 mmHg (Cal.)
• Flash point: 225.727°C (Cal.)