Myo-Inositol Hexanitrate
[CAS# 7332-16-3]

Identification

• Name: Myo-Inositol Hexanitrate
• Synonyms: Nitric Acid (2,3,4,5,6-Pentanitrooxycyclohexyl) Ester; Inositol Hexanitrate; Myo-Inositol Hexanitrate
• Molecular Formula: C₆H₆N₆O₁₈
• Molecular Weight: 450.14
• CAS Registry Number: 7332-16-3
• EINECS: 230-831-6
• SMILES: O=[N+](OC1C(O[N+]([O-])=O)C(O[N+]([O-])=O)C(O[N+]([O-])=O)C(O[N+]([O-])=O)C1O[N+]([O-])=O)[O-]
• InChI: 1S/C6H6N6O18/c13-7(14)25-1-2(26-8(15)16)4(28-10(19)20)6(30-12(23)24)5(29-11(21)22)3(1)27-9(17)18/h1-6H
• InChIKey: VAASRZPDHFMMMC-UHFFFAOYSA-N

Properties

• Density: 2.028g/cm³ (Cal.)
• Boiling point: 590.878°C at 760 mmHg (Cal.)
• Flash point: 268.501°C (Cal.)