1,3,6,8-Tetrahydroxy-2-[(1S)-3-hydroxy-1-(hydroxymethyl)propyl]-9,10-Anthracenedione
[CAS# 22268-13-9]

Identification

• Name: 1,3,6,8-Tetrahydroxy-2-[(1S)-3-hydroxy-1-(hydroxymethyl)propyl]-9,10-Anthracenedione
• Synonyms: 1,3,6,8-Tetrahydroxy-2-[(1S)-3-Hydroxy-1-(Hydroxymethyl)Propyl]Anthracene-9,10-Dione; 1,3,6,8-Tetrahydroxy-2-[(1S)-3-Hydroxy-1-Methylol-Propyl]-9,10-Anthraquinone; 2-[(2S)-1,4-Dihydroxybutan-2-Yl]-1,3,6,8-Tetrahydroxy-Anthracene-9,10-Dione
• Molecular Formula: C₁₈H₁₆O₈
• Molecular Weight: 360.32
• CAS Registry Number: 22268-13-9
• SMILES: [C@H](C3=C(C1=C(C(=O)C2=C(C1=O)C(=CC(=C2)O)O)C=C3O)O)(CO)CCO
• InChI: 1S/C18H16O8/c19-2-1-7(6-20)13-12(23)5-10-15(17(13)25)18(26)14-9(16(10)24)3-8(21)4-11(14)22/h3-5,7,19-23,25H,1-2,6H2/t7-/m1/s1
• InChIKey: ZLIRCPWCWHTYNP-SSDOTTSWSA-N

Properties

• Density: 1.681g/cm³ (Cal.)
• Boiling point: 788.402°C at 760 mmHg (Cal.)
• Flash point: 444.512°C (Cal.)