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CAS No.: | 359880-05-0 |
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Name: | N-Cyclobutyl-4-piperidone |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C9H15NO |
Molecular Weight: | 153.224 |
Synonyms: | 1-Cyclobutyl-4-piperidone; |
Density: | 1.105 g/cm3 |
Boiling Point: | 253.828 °C at 760 mmHg |
Flash Point: | 100.005 °C |
PSA: | 20.31000 |
LogP: | 1.14170 |
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The N-Cyclobutyl-4-piperidone with the cas number 359880-05-0 is also called 4-piperidinone, 1-cyclobutyl-. The systematic name is 1-cyclobutylpiperidin-4-one. Its molecular formula is C9H15NO. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 0.84; (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): 1; (6)ACD/KOC (pH 7.4): 7; (7)#H bond acceptors: 2; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 20.31 Å2; (11)Index of Refraction: 1.536; (12)Molar Refractivity: 43.246 cm3; (13)Molar Volume: 138.642 cm3; (14)Polarizability: 17.144×10-24cm3; (15)Surface Tension: 45.908 dyne/cm; (16)Enthalpy of Vaporization: 49.123 kJ/mol; (17)Vapour Pressure: 0.018 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1CCN(CC1)C2CCC2
(2)InChI: InChI=1/C9H15NO/c11-9-4-6-10(7-5-9)8-2-1-3-8/h8H,1-7H2
(3)InChIKey: VSVXODXTJNWKSM-UHFFFAOYAT