| Identification | |
| Name: | 3-Isoxazolecarbonitrile |
| Synonyms: | Isoxazole-3-carbonitrile; |
| CAS: | 68776-57-8 |
| Molecular Formula: | C4H2N2O |
| Molecular Weight: | 94.07 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.25 g/cm3 |
| Water Solubility: | at 25 deg C (mg/L): 1.055e+005 |
| Solubility: | at 25 deg C (mg/L): 1.055e+005 |
| Specification: |
The CAS register number of Isoxazole-3-carbonitrile is 68776-57-8. It also can be called as 3-Isoxazolecarbonitrile and the systematic name about this chemical is 1,2-oxazole-3-carbonitrile. It belongs to the Isoxazole. Physical properties about Isoxazole-3-carbonitrile are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 13; (4) ACD/KOC (pH 7.4): 13; (5)#H bond acceptors: 3; (6)Polar Surface Area: 49.82Å2; (7)Index of Refraction: 1.489; (8)Molar Refractivity: 21.6 cm3; (9)Molar Volume: 74.7 cm3; (10)Polarizability: 8.56x10-24cm3; (11)Surface Tension: 55.1 dyne/cm; (12)Enthalpy of Vaporization: 46.34 kJ/mol; (13)Boiling Point: 226.8 °C at 760 mmHg; (14)Vapour Pressure: 0.0801 mmHg at 25°C. You can still convert the following datas into molecular structure: |
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