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| CAS No.: | 895573-64-5 |
|---|---|
| Name: | 5-Methyl-3-(piperidin-3-yl)-1,2,4-oxadiazole |
| Molecular Structure: | |
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| Formula: | C8H13N3O |
| Molecular Weight: | 167.21 |
| Synonyms: | 5-Methyl-3-(3-piperidyl)-1,2,4-oxadiazole; |
| Density: | 1.099 g/cm3 |
| Boiling Point: | 296.525 °C at 760 mmHg |
| Flash Point: | 133.134 °C |
| PSA: | 50.95000 |
| LogP: | 1.17380 |
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- Total:25 Page 1 of 1 1
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Specification
The 5-Methyl-3-(piperidin-3-yl)-1,2,4-oxadiazole, with its CAS registry number 895573-64-5, has its systematic name of 5-methyl-3-(3-piperidyl)-1,2,4-oxadiazole. And this chemical has its molecular formula of C8H13N3O and molecular weight of 167.20. Besides, it should be kept at room temperature.
Physical properties of 5-Methyl-3-(piperidin-3-yl)-1,2,4-oxadiazole: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 2.7; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds:1; (8)Polar Surface Area: 50.95 Å2; (9)Index of Refraction: 1.492; (10)Molar Refractivity: 44.158 cm3; (11)Molar Volume: 152.188 cm3; (12)Polarizability: 17.506×10-24cm3; (13)Surface Tension: 41.524 dyne/cm; (14)Density: 1.099 g/cm3; (15)Flash Point: 133.134 °C; (16)Enthalpy of Vaporization: 53.631 kJ/mol; (17)Boiling Point: 296.525 °C at 760 mmHg; (18)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES:Cc1nc(no1)C2CCCNC2
(1)Std. InChI:InChI=1S/C8H13N3O/c1-6-10-8(11-12-6)7-3-2-4-9-5-7/h7,9H,2-5H2,1H3
(1)Std. InChIKey:RNZPWGXBWMZDBW-UHFFFAOYSA-N