[3-(4-Morpholinylcarbonyl)-5-nitrophenyl]boronic acid
[CAS# 871332-80-8]

Identification

• Name: [3-(4-Morpholinylcarbonyl)-5-nitrophenyl]boronic acid
• Synonyms: (3-(Morpholine-4-carbonyl)-5-nitrophenyl)boronic acid; 3-(Morpholine-4-carbonyl)-5-nitrophenylboronic acid; MFCD08056359
• Molecular Formula: C₁₁H₁₃BN₂O₆
• Molecular Weight: 280.04
• CAS Registry Number: 871332-80-8
• SMILES: B(C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2CCOCC2)(O)O
• InChI: 1S/C11H13BN2O6/c15-11(13-1-3-20-4-2-13)8-5-9(12(16)17)7-10(6-8)14(18)19/h5-7,16-17H,1-4H2
• InChIKey: GKGNPJBVECYLOT-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Melting point: 167-169°C (Expl.)
• Boiling point: 568.8±60.0°C at 760 mmHg (Cal.)
• Flash point: 297.8±32.9°C (Cal.)
• Refractive index: 1.608 (Cal.)

Safety Data

• Safety Code: S26;S36/37;S60
• Risk Code: R22;R36/37/38
• Hazard Symbol: X
• Safety Description: IRRITANT