286013-01-2
| Name | 1-(3-Aminophenyl)acetylene-1,2-<sup>13</sup>C<sub>2</sub> |
| CAS | 286013-01-2 |
| Molecular Formula | C8H7N |
| Molecular Weight | 119.13 |
| MOL File | 286013-01-2.mol |
Chemical Properties
| Boiling point | 78-80 °C/2 mmHg (lit.) |
| density | 1.056±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| InChI | 1S/C8H7N/c1-2-7-4-3-5-8(9)6-7/h1,3-6H,9H2/i1+1,2+1 |
| InChIKey | NNKQLUVBPJEUOR-ZDOIIHCHSA-N |
| SMILES | Nc1cccc(c1)[13C]#[13CH] |