2-[4-[(7-Oxo-5-Propyl-1H-Pyrazolo[1,5-a]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid
[CAS# 167375-28-2]

Identification

• Name: 2-[4-[(7-Oxo-5-Propyl-1H-Pyrazolo[1,5-a]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid
• Synonyms: 2-[4-[(7-Keto-5-Propyl-1H-Pyrazolo[1,5-A]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid; (1,1'-Biphenyl)-2-Carboxylic Acid, 4'-((7-Hydroxy-5-Propylpyrazolo(1,5-A)Pyrimidin-6-Yl)Methyl)-; 6-((2'-Carboxybiphenyl-4-Yl)Methyl)-7-Hydroxy-5-Propylpyrazolo(1,5-A)Pyrimidine
• Molecular Formula: C₂₃H₂₁N₃O₃
• Molecular Weight: 387.44
• CAS Registry Number: 167375-28-2
• SMILES: C3=C(CC2=C(N=C1N(NC=C1)C2=O)CCC)C=CC(=C3)C4=CC=CC=C4C(O)=O
• InChI: 1S/C23H21N3O3/c1-2-5-20-19(22(27)26-21(25-20)12-13-24-26)14-15-8-10-16(11-9-15)17-6-3-4-7-18(17)23(28)29/h3-4,6-13,24H,2,5,14H2,1H3,(H,28,29)
• InChIKey: NHHVQPWNYREWJP-UHFFFAOYSA-N

Properties

• Density: 1.292g/cm³ (Cal.)
• Boiling point: 577.43°C at 760 mmHg (Cal.)
• Flash point: 303.019°C (Cal.)