2-(3-(3,5-Di-Tert-Butyl-4-Hydroxyphenyl)-1H-Pyrazolo(3,4-b)Pyridin-1-Yl)Ethyl Acetate
[CAS# 114319-11-8]

Identification

• Name: 2-(3-(3,5-Di-Tert-Butyl-4-Hydroxyphenyl)-1H-Pyrazolo(3,4-b)Pyridin-1-Yl)Ethyl Acetate
• Synonyms: Acetic Acid 2-[3-(3,5-Ditert-Butyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)-2H-Pyrazolo[5,4-B]Pyridin-1-Yl]Ethyl Ester; Acetic Acid 2-[3-(3,5-Ditert-Butyl-4-Keto-1-Cyclohexa-2,5-Dienylidene)-2H-Pyrazolo[5,4-B]Pyridin-1-Yl]Ethyl Ester; 2-[3-(3,5-Ditert-Butyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)-2H-Pyrazolo[5,4-B]Pyridin-1-Yl]Ethyl Ethanoate
• Molecular Formula: C₂₄H₃₁N₃O₃
• Molecular Weight: 409.53
• CAS Registry Number: 114319-11-8
• SMILES: C1=CC=NC2=C1C(NN2CCOC(=O)C)=C3C=C(C(C)(C)C)C(=O)C(=C3)C(C)(C)C
• InChI: 1S/C24H31N3O3/c1-15(28)30-12-11-27-22-17(9-8-10-25-22)20(26-27)16-13-18(23(2,3)4)21(29)19(14-16)24(5,6)7/h8-10,13-14,26H,11-12H2,1-7H3
• InChIKey: XSJLVVSEXQXWNC-UHFFFAOYSA-N

Properties

• Density: 1.157g/cm³ (Cal.)
• Boiling point: 533.705°C at 760 mmHg (Cal.)
• Flash point: 276.575°C (Cal.)