2,4,5-Trimethyl-3,6-dioxo-1,4-cyclohexadiene-1-sulfonic acid
[CAS# 805183-15-7]

Identification

• Name: 2,4,5-Trimethyl-3,6-dioxo-1,4-cyclohexadiene-1-sulfonic acid
• Synonyms: 1,4-CYCLOHEXADIENE-1-SULFONICACID, 2,4,5-TRIMETHYL-3,6-DIOXO-; 2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-diene-1-sulfonic acid
• Molecular Formula: C₉H₁₀O₅S
• Molecular Weight: 230.24
• CAS Registry Number: 805183-15-7
• SMILES: CC1=C(C(=O)C(=C(C1=O)C)S(=O)(=O)O)C
• InChI: 1S/C9H10O5S/c1-4-5(2)8(11)9(15(12,13)14)6(3)7(4)10/h1-3H3,(H,12,13,14)
• InChIKey: XEHYYSLARNLHQZ-UHFFFAOYSA-N

Properties

• Density: 1.471g/cm³ (Cal.)
• Refractive index: 1.568 (Cal.)