2-Methoxy-4-Nitro-5-(Sulphooxy)Phenylammonium Hydrogen Sulphate
[CAS# 97337-95-6]

Identification

• Name: 2-Methoxy-4-Nitro-5-(Sulphooxy)Phenylammonium Hydrogen Sulphate
• Synonyms: Hydrogen Sulfate; (2-Methoxy-4-Nitro-5-Sulfooxy-Phenyl)Ammonium; Hydrogen Sulfate; (2-Methoxy-4-Nitro-5-Sulfooxyphenyl)Ammonium; (2-Methoxy-4-Nitro-5-Sulfoxy-Phenyl)Ammonium Bisulfate
• Molecular Formula: C₇H₁₀N₂O₁₁S₂
• Molecular Weight: 362.28
• CAS Registry Number: 97337-95-6
• EINECS: 306-589-3
• SMILES: C1=C([NH3+])C(=CC(=C1O[S](O)(=O)=O)[N+]([O-])=O)OC.O=[S](O)([O-])=O
• InChI: 1S/C7H8N2O7S.H2O4S/c1-15-6-3-5(9(10)11)7(2-4(6)8)16-17(12,13)14;1-5(2,3)4/h2-3H,8H2,1H3,(H,12,13,14);(H2,1,2,3,4)
• InChIKey: QUTAKWQOOATIDT-UHFFFAOYSA-N

Properties

• Boiling point: 765.3°C at 760 mmHg (Cal.)
• Flash point: 416.6°C (Cal.)