1-(2-Aminophenyl)-2-heptyn-1-one
[CAS# 862250-85-9]

Identification

• Name: 1-(2-Aminophenyl)-2-heptyn-1-one
• Synonyms: 1-(2-aminophenyl)hept-2-yn-1-one; 2-Heptyn-1-one,1-(2-aminophenyl)-
• Molecular Formula: C₁₃H₁₅NO
• Molecular Weight: 201.26
• CAS Registry Number: 862250-85-9
• SMILES: CCCCC#CC(=O)c1ccccc1N
• InChI: 1S/C13H15NO/c1-2-3-4-5-10-13(15)11-8-6-7-9-12(11)14/h6-9H,2-4,14H2,1H3
• InChIKey: PYMYLXSVMBYUNT-UHFFFAOYSA-N

Properties

• Density: 1.064g/cm³ (Cal.)
• Boiling point: 352.022°C at 760 mmHg (Cal.)
• Flash point: 166.697°C (Cal.)
• Refractive index: 1.566 (Cal.)