Methyl 2-(Bromomethyl)-3,5-Dinitrobenzoate
[CAS# 153754-31-5]

Identification

• Name: Methyl 2-(Bromomethyl)-3,5-Dinitrobenzoate
• Synonyms: 2-(Bromométhyl)-3,5-dinitrobenzoate de méthyle; 2-(Bromomethyl)-3,5-dinitrobenzoic acid methyl ester; Benzoic acid, 2-(bromomethyl)-3,5-dinitro-, methyl ester
• Molecular Formula: C₉H₇BrN₂O₆
• Molecular Weight: 319.07
• CAS Registry Number: 153754-31-5
• SMILES: COC(=O)c1cc(cc(c1CBr)[N+](=O)[O-])[N+](=O)[O-]
• InChI: 1S/C9H7BrN2O6/c1-18-9(13)6-2-5(11(14)15)3-8(12(16)17)7(6)4-10/h2-3H,4H2,1H3
• InChIKey: OZTMRDHUKBJZEB-UHFFFAOYSA-N

Properties

• Density: 1.8±0.1g/cm³ (Cal.)
• Boiling point: 448.9±45.0°C at 760 mmHg (Cal.)
• Flash point: 225.3±28.7°C (Cal.)
• Refractive index: 1.624 (Cal.)

Safety Data

• Safety Description: IRRITANT