7-[5-(2-Amino-2-Carboxyethyl)-2-Hydroxyphenyl]-3,5,6,8-Tetrahydroxy-9,10-Dioxo-9,10-Dihydro-1,2-Anthracenedicarboxylic Acid
[CAS# 23241-56-7]

Identification

• Name: 7-[5-(2-Amino-2-Carboxyethyl)-2-Hydroxyphenyl]-3,5,6,8-Tetrahydroxy-9,10-Dioxo-9,10-Dihydro-1,2-Anthracenedicarboxylic Acid
• Synonyms: laccaic acid C
• Molecular Formula: C₂₅H₁₇NO₁₃
• Molecular Weight: 539.40
• CAS Registry Number: 23241-56-7
• SMILES: C1=CC(=C(C=C1CC(C(=O)O)N)C2=C(C3=C(C(=C2O)O)C(=O)C4=CC(=C(C(=C4C3=O)C(=O)O)C(=O)O)O)O)O
• InChI: 1S/C25H17NO13/c26-9(23(34)35)4-6-1-2-10(27)7(3-6)13-20(31)17-16(22(33)21(13)32)18(29)8-5-11(28)14(24(36)37)15(25(38)39)12(8)19(17)30/h1-3,5,9,27-28,31-33H,4,26H2,(H,34,35)(H,36,37)(H,38,39)
• InChIKey: VRXULZFQCGXCRV-UHFFFAOYSA-N

Properties

• Density: 1.9±0.1g/cm³ (Cal.)
• Boiling point: 971.0±65.0°C at 760 mmHg (Cal.)
• Flash point: 541.0±34.3°C (Cal.)
• Refractive index: 1.818 (Cal.)