6-Hydroxy-1-(3-Isopropoxypropyl)-5-[(E)-(4-Methoxy-2-Nitrophenyl)Diazenyl]-4-Methyl-2-Oxo-1,2-Dihydro-3-Pyridinecarbonitrile
[CAS# 168400-08-6]

Identification

• Name: 6-Hydroxy-1-(3-Isopropoxypropyl)-5-[(E)-(4-Methoxy-2-Nitrophenyl)Diazenyl]-4-Methyl-2-Oxo-1,2-Dihydro-3-Pyridinecarbonitrile
• Synonyms: 3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-5-[(E)-2-(4-methoxy-2-nitrophenyl)diazenyl]-4-methyl-1-[3-(1-methylethoxy)propyl]-2-oxo-; 3-PYRIDINECARBONITRILE,1,2-DIHYDRO-6-HYDROXY-5-[(4-METHOXY-2-NITROPHENYL)AZO]-4-METHYL-1-[3-(1-METHYLETHOXY)PROPYL]-2-OXO-
• Molecular Formula: C₂₀H₂₃N₅O₆
• Molecular Weight: 429.43
• CAS Registry Number: 168400-08-6
• SMILES: Cc1c(c(=O)n(c(c1/N=N/c2ccc(cc2[N+](=O)[O-])OC)O)CCCOC(C)C)C#N
• InChI: 1S/C20H23N5O6/c1-12(2)31-9-5-8-24-19(26)15(11-21)13(3)18(20(24)27)23-22-16-7-6-14(30-4)10-17(16)25(28)29/h6-7,10,12,27H,5,8-9H2,1-4H3/b23-22+
• InChIKey: ZCRDIABLQIFINU-GHVJWSGMSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 543.1±50.0°C at 760 mmHg (Cal.)
• Flash point: 282.3±30.1°C (Cal.)
• Refractive index: 1.602 (Cal.)