(1S)-1-(2,3-Dihydro-1-Benzofuran-7-Yl)-3-Methyl-7-Nitro-1,2,4,5-Tetrahydro-3-Benzazepin-8-Ol
[CAS# 128022-68-4]

Identification

• Name: (1S)-1-(2,3-Dihydro-1-Benzofuran-7-Yl)-3-Methyl-7-Nitro-1,2,4,5-Tetrahydro-3-Benzazepin-8-Ol
• Synonyms: 1H-3-Benzazepin-7-Ol, 5-(2,3-Dihydro-7-Benzofuranyl)-2,3,4,5-Tetrahydro-3-Methyl-8-Nitro-, (S)-; 5-(2,3-Dihydrobenzofuran-7-Yl)-3-Methyl-8-Nitro-2,3,4,5-Tetrahydro-1H-3-Benzazepin-7-Ol; (1S)-1-(2,3-Dihydrobenzofuran-7-Yl)-3-Methyl-7-Nitro-1,2,4,5-Tetrahydro-3-Benzazepin-8-Ol
• Molecular Formula: C₁₉H₂₀N₂O₄
• Molecular Weight: 340.38
• CAS Registry Number: 128022-68-4
• SMILES: [C@H]2(C1=CC(=C([N+]([O-])=O)C=C1CCN(C2)C)O)C4=C3OCCC3=CC=C4
• InChI: 1S/C19H20N2O4/c1-20-7-5-13-9-17(21(23)24)18(22)10-15(13)16(11-20)14-4-2-3-12-6-8-25-19(12)14/h2-4,9-10,16,22H,5-8,11H2,1H3/t16-/m1/s1
• InChIKey: XZPSYCOYKJRHKE-MRXNPFEDSA-N

Properties

• Density: 1.311g/cm³ (Cal.)
• Boiling point: 477.305°C at 760 mmHg (Cal.)
• Flash point: 242.466°C (Cal.)