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CAS No.: | 406235-30-1 |
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Name: | N-BOC-4-METHYL-4-HYDROXY PIPERIDINE |
Article Data: | 35 |
Molecular Structure: | |
Formula: | C11H21NO3 |
Molecular Weight: | 215.293 |
Synonyms: | 4-Hydroxy-4-methylpiperidine-1-carboxylicacid tert-butyl ester;tert-Butyl 4-hydroxy-4-methylpiperidine-1-carboxylate; |
Density: | 1.076 g/cm3 |
Boiling Point: | 296.362 °C at 760 mmHg |
Flash Point: | 133.035 °C |
PSA: | 49.77000 |
LogP: | 1.70620 |
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This chemical is called tert-Butyl 4-hydroxy-4-methylpiperidine-1-carboxylate, and its CAS registry number is 406235-30-1. With the molecular formula of C11H21NO3, its molecular weight is 215.29.
Other characteristics of the tert-Butyl 4-hydroxy-4-methylpiperidine-1-carboxylate can be summarised as followings: (1)ACD/LogP: 1.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 101; (8)ACD/KOC (pH 7.4): 101; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 49.77 Å2; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 57.644 cm3; (15)Molar Volume: 200.107 cm3; (16)Polarizability: 22.852×10-24cm3; (17)Surface Tension: 39.749 dyne/cm; (18)Density: 1.076 g/cm3; (19)Flash Point: 133.035 °C; (20)Enthalpy of Vaporization: 62.197 kJ/mol; (21)Boiling Point: 296.362 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CC(C)(C)OC(=O)N1CCC(C)(O)CC1
2.InChI: InChI=1/C11H21NO3/c1-10(2,3)15-9(13)12-7-5-11(4,14)6-8-12/h14H,5-8H2,1-4H3
3.InChIKey: SWUCHJAQBNXPBO-UHFFFAOYAO