5-(3-Fluorophenyl)-7-Nitro-1,3-Dihydro-1,4-Benzodiazepin-2-One
[CAS# 2558-30-7]

Identification

• Classification: Analytical chemistry >> Standard >> Standard material
• Name: 5-(3-Fluorophenyl)-7-Nitro-1,3-Dihydro-1,4-Benzodiazepin-2-One
• Synonyms: 5-(2-Fluorophenyl)-1,3-Dihydro-7-Nitro-2H-1,4-Benzodiazepin-2-One
• Molecular Formula: C₁₅H₁₀FN₃O₃
• Molecular Weight: 299.26
• CAS Registry Number: 2558-30-7
• EINECS: 219-878-3
• SMILES: C1=CC2=C(C=C1[N+]([O-])=O)C(=NCC(=O)N2)C3=CC(=CC=C3)F
• InChI: 1S/C15H10FN3O3/c16-10-3-1-2-9(6-10)15-12-7-11(19(21)22)4-5-13(12)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)
• InChIKey: GAFGVIXGAAPSTO-UHFFFAOYSA-N

Properties

• Density: 1.47g/cm³ (Cal.)
• Boiling point: 500.112°C at 760 mmHg (Cal.)
• Flash point: 256.259°C (Cal.)