4-Nitrobenzyl Mercaptan S-Sulfate
[CAS# 66138-16-7]

Identification

• Name: 4-Nitrobenzyl Mercaptan S-Sulfate
• Synonyms: 1-Nitro-4-[(Sulfothio)Methyl]Benzene; Nbm-S-Sulfate; Thiosulfuric Acid (H2s2o3), S-((4-Nitrophenyl)Methyl) Ester
• Molecular Formula: C₇H₇NO₅S₂
• Molecular Weight: 249.26
• CAS Registry Number: 66138-16-7
• SMILES: C1=C(CS[S](=O)(=O)O)C=CC(=C1)[N+]([O-])=O
• InChI: 1S/C7H7NO5S2/c9-8(10)7-3-1-6(2-4-7)5-14-15(11,12)13/h1-4H,5H2,(H,11,12,13)
• InChIKey: MILSHAWIUIPRBH-UHFFFAOYSA-N

Properties

• Density: 1.661g/cm³ (Cal.)