1-Phenyl-4-Hexyn-3-One
[CAS# 122124-41-8]

Identification

• Name: 1-Phenyl-4-Hexyn-3-One
• Synonyms: 1-Phenyl-4-hexyn-3-one
• Molecular Formula: C₁₂H₁₂O
• Molecular Weight: 172.22
• CAS Registry Number: 122124-41-8
• SMILES: O=C(C#CC)CCc1ccccc1
• InChI: 1S/C12H12O/c1-2-6-12(13)10-9-11-7-4-3-5-8-11/h3-5,7-8H,9-10H2,1H3
• InChIKey: XRHXLHINNLXPNU-UHFFFAOYSA-N

Properties

• Density: 1.021g/cm³ (Cal.)
• Boiling point: 287.724°C at 760 mmHg (Cal.)
• Flash point: 107.171°C (Cal.)
• Refractive index: 1.533 (Cal.)