5-(2-Hydroxyethylamino)-3-(Hydroxymethyl)-2-[(E)-3-Hydroxyprop-1-Enyl]-1-Methylindole-4,7-Dione
[CAS# 131610-90-7]

Identification

• Name: 5-(2-Hydroxyethylamino)-3-(Hydroxymethyl)-2-[(E)-3-Hydroxyprop-1-Enyl]-1-Methylindole-4,7-Dione
• Synonyms: 5-(2-Hydroxyethylamino)-3-(Hydroxymethyl)-2-[(E)-3-Hydroxyprop-1-Enyl]-1-Methyl-Indole-4,7-Dione; 5-(2-Hydroxyethylamino)-2-[(E)-3-Hydroxyprop-1-Enyl]-1-Methyl-3-Methylol-Indole-4,7-Quinone; 1H-Indole-4,7-Dione, 5-((2-Hydroxyethyl)Amino)-3-(Hydroxymethyl)-2-((1E)-3-Hydroxy-1-Propenyl)-1-Methyl-
• Molecular Formula: C₁₅H₁₈N₂O₅
• Molecular Weight: 306.32
• CAS Registry Number: 131610-90-7
• SMILES: C(O)C1=C([N](C2=C1C(=O)C(=CC2=O)NCCO)C)\C=C\CO
• InChI: 1S/C15H18N2O5/c1-17-11(3-2-5-18)9(8-20)13-14(17)12(21)7-10(15(13)22)16-4-6-19/h2-3,7,16,18-20H,4-6,8H2,1H3/b3-2+
• InChIKey: CARMVIUSEAHWMX-NSCUHMNNSA-N

Properties

• Density: 1.404g/cm³ (Cal.)
• Boiling point: 684.811°C at 760 mmHg (Cal.)
• Flash point: 367.961°C (Cal.)