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| CAS No.: | 73290-32-1 |
|---|---|
| Name: | 5-ETHYL-2,4-PIPERIDINEDIONE |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C7H11NO2 |
| Molecular Weight: | 141.17 |
| Synonyms: | 2,4-Piperidinedione,5-ethyl-, (?à)-;5-Ethyl-2,4-piperidinedione;5-Ethylpiperidine-2,4-dione; |
| Density: | 1.06 g/cm3 |
| Melting Point: | 72-74 °C |
| Boiling Point: | 340.4 °C at 760 mmHg |
| Flash Point: | 166.4 °C |
| PSA: | 46.17000 |
| LogP: | 0.43040 |
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Specification
The 2,4-Piperidinedione,5-ethyl-, with the CAS registry number 73290-32-1, has the systematic name of 5-Ethylpiperidine-2,4-dione. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C7H11NO2.
The characteristics of 2,4-Piperidinedione,5-ethyl- are as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 4.46; (5)ACD/KOC (pH 7.4): 4.46; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 46.17 Å2; (10)Index of Refraction: 1.453; (11)Molar Refractivity: 35.99 cm3; (12)Molar Volume: 133 cm3; (13)Polarizability: 14.26×10-24cm3; (14)Surface Tension: 32.3 dyne/cm; (15)Density: 1.06 g/cm3; (16)Flash Point: 166.4 °C; (17)Enthalpy of Vaporization: 58.39 kJ/mol; (18)Boiling Point: 340.4 °C at 760 mmHg; (19)Vapour Pressure: 8.64E-05 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CCC1CNC(=O)CC1=O
(2)InChI: InChI=1/C7H11NO2/c1-2-5-4-8-7(10)3-6(5)9/h5H,2-4H2,1H3,(H,8,10)
(3)InChIKey: BIPNFYPMYSWIGH-UHFFFAOYAP