3-Methyl-5,6-dioxo-1,3-cyclohexadiene-1-sulfonic acid
[CAS# 773028-46-9]

Identification

• Name: 3-Methyl-5,6-dioxo-1,3-cyclohexadiene-1-sulfonic acid
• Synonyms: 3-methyl-5,6-dioxocyclohexa-1,3-diene-1-sulfonic acid
• Molecular Formula: C₇H₆O₅S
• Molecular Weight: 202.18
• CAS Registry Number: 773028-46-9
• SMILES: CC1=CC(=O)C(=O)C(=C1)S(=O)(=O)O
• InChI: 1S/C7H6O5S/c1-4-2-5(8)7(9)6(3-4)13(10,11)12/h2-3H,1H3,(H,10,11,12)
• InChIKey: JSOFKLQEMBWUFE-UHFFFAOYSA-N

Properties

• Density: 1.63g/cm³ (Cal.)
• Refractive index: 1.599 (Cal.)