Miserotoxin
[CAS# 24502-76-9]

Identification

• Name: Miserotoxin
• Synonyms: (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(3-Nitropropoxy)Tetrahydropyran-3,4,5-Triol; (2R,3S,4S,5R,6R)-2-Methylol-6-(3-Nitropropoxy)Tetrahydropyran-3,4,5-Triol; C08507
• Molecular Formula: C₉H₁₇NO₈
• Molecular Weight: 267.24
• CAS Registry Number: 24502-76-9
• SMILES: [C@H]1([C@H]([C@@H]([C@@H](CO)O[C@H]1OCCC[N+]([O-])=O)O)O)O
• InChI: 1S/C9H17NO8/c11-4-5-6(12)7(13)8(14)9(18-5)17-3-1-2-10(15)16/h5-9,11-14H,1-4H2/t5-,6-,7+,8-,9-/m1/s1
• InChIKey: JDJSHLXEHWCLEP-SYHAXYEDSA-N

Properties

• Density: 1.512g/cm³ (Cal.)
• Boiling point: 519.157°C at 760 mmHg (Cal.)
• Flash point: 267.777°C (Cal.)