3-[2-(Methylamino)ethyl]-1H-Indol-4-ol 4-(dihydrogen phosphate)
[CAS# 21420-58-6]

Identification

• Name: 3-[2-(Methylamino)ethyl]-1H-Indol-4-ol 4-(dihydrogen phosphate)
• Synonyms: Baeocystin; 1H-Indol-4-Ol, 3-(2-(Methylamino)Ethyl)-, Dihydrogen Phosphate (Ester)
• Molecular Formula: C₁₁H₁₅N₂O₄P
• Molecular Weight: 270.22
• CAS Registry Number: 21420-58-6
• SMILES: C1=C(C2=C([NH]1)C=CC=C2O[P](=O)(O)O)CCNC
• InChI: 1S/C11H15N2O4P/c1-12-6-5-8-7-13-9-3-2-4-10(11(8)9)17-18(14,15)16/h2-4,7,12-13H,5-6H2,1H3,(H2,14,15,16)
• InChIKey: WTPBXXCVZZZXKR-UHFFFAOYSA-N

Properties

• Density: 1.448g/cm³ (Cal.)
• Boiling point: 538.249°C at 760 mmHg (Cal.)
• Flash point: 279.323°C (Cal.)