1-(1H-Pyrazol-1-Yl)-1-Octanone
[CAS# 541545-95-3]

Identification

• Name: 1-(1H-Pyrazol-1-Yl)-1-Octanone
• Synonyms: 1-(1H-pyrazol-1-yl)octan-1-one; 1H-Pyrazole,1-(1-oxooctyl)-
• Molecular Formula: C₁₁H₁₈N₂O
• Molecular Weight: 194.27
• CAS Registry Number: 541545-95-3
• SMILES: O=C(n1nccc1)CCCCCCC
• InChI: 1S/C11H18N2O/c1-2-3-4-5-6-8-11(14)13-10-7-9-12-13/h7,9-10H,2-6,8H2,1H3
• InChIKey: WGIORHCHHVSCHP-UHFFFAOYSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 296.735°C at 760 mmHg (Cal.)
• Flash point: 133.261°C (Cal.)
• Refractive index: 1.516 (Cal.)