| Identification | |
| Name: | 1-N-(Methylsulfonyl)-4-piperidinone |
| Synonyms: | 1-(Methylsulfonyl)-4-piperidone, 97%;1-Methylsulfonyl-4-piperidone; |
| CAS: | 218780-53-1 |
| Molecular Formula: | C6H11NO3S |
| Molecular Weight: | 177.22 |
| InChI: | InChI=1/C6H11NO3S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5H2,1H3 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.332 g/cm3 |
| Refractive index: | 1.522 |
| Specification: |
The 1-N-(Methylsulfonyl)-4-piperidinone with the cas number 218780-53-1 is also called 1-Methylsulfonyl-4-piperidone. The systematic name is 1-(methylsulfonyl)piperidin-4-one. Its molecular formula is C6H11NO3S. It should be stored in dry and cool environment. The properties of the chemical are: (1)ACD/LogP: -0.73; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 8; (6)ACD/KOC (pH 7.4): 8; (7)#H bond acceptors: 4; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 62.83Å2; (11)Index of Refraction: 1.522; (12)Molar Refractivity: 40.596 cm3; (13)Molar Volume: 133.06 cm3; (14)Polarizability: 16.093×10-24cm3; (15)Surface Tension: 48.899 dyne/cm; (16)Enthalpy of Vaporization: 56.208 kJ/mol; (17)Vapour Pressure: 0 mmHg at 25°C. You can still convert the following datas into molecular structure: |
| Safety Data | |
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