2-[(1,4-Dihydroxy-9,10-Dioxo-2-Anthryl)Thio]Ethyl Benzoate
[CAS# 49831-04-1]

Identification

• Name: 2-[(1,4-Dihydroxy-9,10-Dioxo-2-Anthryl)Thio]Ethyl Benzoate
• Synonyms: 2-[(1,4-Dihydroxy-9,10-Dioxo-2-Anthryl)Sulfanyl]Ethyl Benzoate; Benzoic Acid 2-[(1,4-Dihydroxy-9,10-Dioxo-2-Anthryl)Thio]Ethyl Ester; Benzoic Acid 2-[(1,4-Dihydroxy-9,10-Diketo-2-Anthryl)Thio]Ethyl Ester
• Molecular Formula: C₂₃H₁₆O₆S
• Molecular Weight: 420.44
• CAS Registry Number: 49831-04-1
• EINECS: 256-497-1
• SMILES: C3=C(O)C1=C(C(=O)C2=C(C1=O)C=CC=C2)C(=C3SCCOC(=O)C4=CC=CC=C4)O
• InChI: 1S/C23H16O6S/c24-16-12-17(30-11-10-29-23(28)13-6-2-1-3-7-13)22(27)19-18(16)20(25)14-8-4-5-9-15(14)21(19)26/h1-9,12,24,27H,10-11H2
• InChIKey: DMLGTNUPSULYID-UHFFFAOYSA-N

Properties

• Density: 1.525g/cm³ (Cal.)
• Boiling point: 634.706°C at 760 mmHg (Cal.)
• Flash point: 337.659°C (Cal.)