3-Nitrobenzenesulfonic Acid Monohydrate
[CAS# 5337-19-9]

Identification

• Name: 3-Nitrobenzenesulfonic Acid Monohydrate
• Synonyms: Nsc419; Phosphonic Acid, (3-Nitrophenyl)-; Phosphonic Acid, (M-Nitrophenyl)-
• Molecular Formula: C₆H₆NO₅P
• Molecular Weight: 203.09
• CAS Registry Number: 5337-19-9
• EINECS: 226-261-2
• SMILES: C1=C(C=CC=C1[P](O)(O)=O)[N+](=O)[O-]
• InChI: 1S/C6H6NO5P/c8-7(9)5-2-1-3-6(4-5)13(10,11)12/h1-4H,(H2,10,11,12)
• InChIKey: OXWXINKWKITCIH-UHFFFAOYSA-N

Properties

• Density: 1.649g/cm³ (Cal.)
• Boiling point: 446.345°C at 760 mmHg (Cal.)
• Flash point: 223.741°C (Cal.)