3-Nitrodibenzothiophene-5-Oxide
[CAS# 68925-98-4]

Identification

• Name: 3-Nitrodibenzothiophene-5-Oxide
• Synonyms: Nsc170578; Ncistruc2_000938; Ncgc00014498
• Molecular Formula: C₁₂H₇NO₃S
• Molecular Weight: 245.25
• CAS Registry Number: 68925-98-4
• SMILES: [S]1(=O)C3=C(C2=C1C=CC=C2)C=CC(=C3)[N+]([O-])=O
• InChI: 1S/C12H7NO3S/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)17(16)12(10)7-8/h1-7H
• InChIKey: BBSNLPXHXFJCJE-UHFFFAOYSA-N

Properties

• Density: 1.603g/cm³ (Cal.)
• Boiling point: 481.584°C at 760 mmHg (Cal.)
• Flash point: 245.053°C (Cal.)