3-(4-Methoxyphenyl)-5-(methylsulfanyl)-1-phenyl-1H-pyrazole
[CAS# 871110-00-8]

Identification

• Name: 3-(4-Methoxyphenyl)-5-(methylsulfanyl)-1-phenyl-1H-pyrazole
• Synonyms: 1H-PYRAZOLE,3-(4-METHOXYPHENYL)-5-(METHYLTHIO)-1-PHENYL-
• Molecular Formula: C₁₇H₁₆N₂OS
• Molecular Weight: 296.39
• CAS Registry Number: 871110-00-8
• SMILES: O(c3ccc(c2nn(c1ccccc1)c(SC)c2)cc3)C
• InChI: 1S/C17H16N2OS/c1-20-15-10-8-13(9-11-15)16-12-17(21-2)19(18-16)14-6-4-3-5-7-14/h3-12H,1-2H3
• InChIKey: AECUHZRLPRQRMG-UHFFFAOYSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 470.041°C at 760 mmHg (Cal.)
• Flash point: 238.072°C (Cal.)
• Refractive index: 1.614 (Cal.)