[(5S)-2-Amino-5-(Dimethylaminomethyl)-4,5-Dihydroimidazol-1-Yl] Methyl Hydrogen Phosphate
[CAS# 103170-78-1]

Identification

• Name: [(5S)-2-Amino-5-(Dimethylaminomethyl)-4,5-Dihydroimidazol-1-Yl] Methyl Hydrogen Phosphate
• Synonyms: (5S)-2-Amino-1-((Hydroxymethoxyphosphinyl)Oxy)-N,N-Dimethyl-4,5-Dihydro-1H-Imidazole-5-Methanamine; 1H-Imidazole-5-Methanamine, 2-Amino-4,5-Dihydro-1-((Hydroxymethoxyphosphinyl)Oxy)-N,N-Dimethyl-, (5S)-; Anatoxin-A(S)
• Molecular Formula: C₇H₁₇N₄O₄P
• Molecular Weight: 252.21
• CAS Registry Number: 103170-78-1
• SMILES: [C@H]1(N(O[P](OC)(=O)O)C(=NC1)N)CN(C)C
• InChI: 1S/C7H17N4O4P/c1-10(2)5-6-4-9-7(8)11(6)15-16(12,13)14-3/h6H,4-5H2,1-3H3,(H2,8,9)(H,12,13)/t6-/m1/s1
• InChIKey: FYXHGVMFJYHPFX-ZCFIWIBFSA-N

Properties

• Density: 1.526g/cm³ (Cal.)
• Boiling point: 361.742°C at 760 mmHg (Cal.)
• Flash point: 172.576°C (Cal.)