3-[1-(4-Bromophenyl)-3-(4-chlorophenyl)-1H-pyrazol-4-yl]propanoic acid
[CAS# 870704-03-3]

Identification

• Name: 3-[1-(4-Bromophenyl)-3-(4-chlorophenyl)-1H-pyrazol-4-yl]propanoic acid
• Synonyms: 1- -3- PYR&; 1-(4-Bromophenyl)-3-(4-chlorophenyl)pyrazole-4-propionic acid; 1-(4-Bromphenyl)-3-(4-chlorphenyl)-pyrazol-4-propions??ure
• Molecular Formula: C₁₈H₁₄BrClN₂O₂
• Molecular Weight: 405.67
• CAS Registry Number: 870704-03-3
• SMILES: C1=CC(=CC=C1C2=NN(C=C2CCC(=O)O)C3=CC=C(C=C3)Br)Cl
• InChI: 1S/C18H14BrClN2O2/c19-14-4-8-16(9-5-14)22-11-13(3-10-17(23)24)18(21-22)12-1-6-15(20)7-2-12/h1-2,4-9,11H,3,10H2,(H,23,24)
• InChIKey: CRCKLQOTWRGUSH-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 564.0±50.0°C at 760 mmHg (Cal.)
• Flash point: 294.9±30.1°C (Cal.)
• Refractive index: 1.656 (Cal.)