2-(2-Carboxy-4-Nitrophenyl)Disulfanyl-5-Nitrobenzoic Acid
[CAS# 1170-38-3]

Identification

• Name: 2-(2-Carboxy-4-Nitrophenyl)Disulfanyl-5-Nitrobenzoic Acid
• Synonyms: 2-(2-Carboxy-4-Nitro-Phenyl)Disulfanyl-5-Nitro-Benzoic Acid; Nsc517871
• Molecular Formula: C₁₄H₈N₂O₈S₂
• Molecular Weight: 396.35
• CAS Registry Number: 1170-38-3
• SMILES: C1=C(C(=CC(=C1)[N+](=O)[O-])C(O)=O)SSC2=C(C=C([N+](=O)[O-])C=C2)C(O)=O
• InChI: 1S/C14H8N2O8S2/c17-13(18)9-5-7(15(21)22)1-3-11(9)25-26-12-4-2-8(16(23)24)6-10(12)14(19)20/h1-6H,(H,17,18)(H,19,20)
• InChIKey: DUXMDNPYAFSEDK-UHFFFAOYSA-N

Properties

• Density: 1.787g/cm³ (Cal.)
• Boiling point: 626.055°C at 760 mmHg (Cal.)
• Flash point: 332.427°C (Cal.)