3-(1H-1,2,4-Triazol-1-yl)-1-adamantanamine
[CAS# 915920-86-4]

Identification

• Name: 3-(1H-1,2,4-Triazol-1-yl)-1-adamantanamine
• Synonyms: (1r,3s,5R,7S)-3-(1H-1,2,4-triazol-1-yl)adamantan-1-amine; 3-(1H-1,2,4-triazol-1-yl)-1-adamantanamine; MFCD08691741
• Molecular Formula: C₁₂H₁₈N₄
• Molecular Weight: 218.30
• CAS Registry Number: 915920-86-4
• SMILES: C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)N
• InChI: 1S/C12H18N4/c13-11-2-9-1-10(3-11)5-12(4-9,6-11)16-8-14-7-15-16/h7-10H,1-6,13H2
• InChIKey: MEBRHDOGOQBNLX-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 370.8±44.0°C at 760 mmHg (Cal.)
• Flash point: 178.0±28.4°C (Cal.)
• Refractive index: 1.82 (Cal.)