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CAS No.: | 24211-54-9 |
---|---|
Name: | (S)-5-HYDROXY-PIPERIDIN-2-ONE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C5H9NO2 |
Molecular Weight: | 115.132 |
Synonyms: | 2-Piperidinone,5-hydroxy-, (S)-;2-Piperidone, 5-hydroxy-, stereoisomer (8CI);(S)-5-Hydroxy-2-piperidinone; |
Density: | 1.2 g/cm3 |
Melting Point: | 123-124℃ (methanol ethyl ether ) |
Boiling Point: | 352.263 °C at 760 mmHg |
Flash Point: | 166.843 °C |
Hazard Symbols: | Xi |
Risk Codes: | 41 |
Safety: | 26-39 |
PSA: | 49.33000 |
LogP: | -0.41390 |
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The 2-Piperidinone,5-hydroxy-, (5S)- is an organic compound with the formula C5H9NO2. The systematic name of this chemical is (5S)-5-hydroxypiperidin-2-one. With the CAS registry number 24211-54-9, it is also named as (S)-5-Hydroxy-piperidin-2-one. The product's category is Pharmacetical.
Physical properties about 2-Piperidinone,5-hydroxy-, (5S)- are: (1)ACD/LogP: -1.32; (2)ACD/LogD (pH 5.5): -2; (3)ACD/LogD (pH 7.4): -2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2; (7)ACD/KOC (pH 7.4): 2; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 49.33 Å2; (12)Index of Refraction: 1.498; (13)Molar Refractivity: 28.128 cm3; (14)Molar Volume: 95.972 cm3; (15)Polarizability: 11.151×10-24cm3; (16)Surface Tension: 45.326 dyne/cm; (17)Density: 1.2 g/cm3; (18)Flash Point: 166.843 °C; (19)Enthalpy of Vaporization: 69.132 kJ/mol; (20)Boiling Point: 352.263 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC[C@@H](O)CC1
(2)InChI: InChI=1/C5H9NO2/c7-4-1-2-5(8)6-3-4/h4,7H,1-3H2,(H,6,8)/t4-/m0/s1
(3)InChIKey: GPRZVNYVEZZOKH-BYPYZUCNBB
(4)Std. InChI: InChI=1S/C5H9NO2/c7-4-1-2-5(8)6-3-4/h4,7H,1-3H2,(H,6,8)/t4-/m0/s1
(5)Std. InChIKey: GPRZVNYVEZZOKH-BYPYZUCNSA-N