2,3-Dichloro-5-[(4S)-6,8-Dichloro-4H-1,3-Benzodioxin-4-Yl]-4-Nitro-1H-Pyrrole
[CAS# 105888-54-8]

Identification

• Name: 2,3-Dichloro-5-[(4S)-6,8-Dichloro-4H-1,3-Benzodioxin-4-Yl]-4-Nitro-1H-Pyrrole
• Synonyms: 1H-Pyrrole, 2,3-Dichloro-5-(6,8-Dichloro-4H-1,3-Benzodioxin-4-Yl)-4-Nitro-, (-)-; 4,5-Dichloro-2-(6',8'-Dichloro-4'-H-1,3-Benzodioxin-4'-Yl)-3-Nitropyrrole; Al-R2081
• Molecular Formula: C₁₂H₆Cl₄N₂O₄
• Molecular Weight: 384.00
• CAS Registry Number: 105888-54-8
• SMILES: [C@@H]1(OCOC2=C1C=C(Cl)C=C2Cl)C3=C([N+]([O-])=O)C(=C(Cl)[NH]3)Cl
• InChI: 1S/C12H6Cl4N2O4/c13-4-1-5-10(6(14)2-4)21-3-22-11(5)8-9(18(19)20)7(15)12(16)17-8/h1-2,11,17H,3H2/t11-/m0/s1
• InChIKey: CUPRKSFMHRXAFA-NSHDSACASA-N

Properties

• Density: 1.741g/cm³ (Cal.)
• Boiling point: 508.164°C at 760 mmHg (Cal.)
• Flash point: 261.129°C (Cal.)