287111-09-5
| Name | Octanoic acid-7,8-<sup>13</sup>C<sub>2</sub> |
| CAS | 287111-09-5 |
| Molecular Formula | C8H16O2 |
| Molecular Weight | 146.2 |
| MOL File | 287111-09-5.mol |
Chemical Properties
| Melting point | 16 °C (lit.) |
| Boiling point | 237 °C (lit.) |
| density | 0.929±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| InChI | 1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/i1+1,2+1 |
| InChIKey | WWZKQHOCKIZLMA-ZDOIIHCHSA-N |
| SMILES | [13CH3][13CH2]CCCCCC(O)=O |