The 1-Boc-4-Methylaminopiperidine, with the CAS registry number 147539-41-1, is also known as tert-Butyl 4-(methylamino)piperidine-1-carboxylate. It belongs to the product categories of Pharmacetical; Piperidine. This chemical's molecular formula is C11H22N2O2 and molecular weight is 214.30. Its IUPAC name is called tert-butyl 4-(methylamino)piperidine-1-carboxylate.
Physical properties of 1-Boc-4-Methylaminopiperidine: (1)ACD/LogP: 1.39; (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): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.485; (11)Molar Refractivity: 60.306 cm3; (12)Molar Volume: 210.398 cm3; (13)Surface Tension: 36.002 dyne/cm; (14)Density: 1.019 g/cm3; (15)Flash Point: 128.585 °C; (16)Enthalpy of Vaporization: 52.828 kJ/mol; (17)Boiling Point: 289.003 °C at 760 mmHg; (18)Vapour Pressure: 0.002 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
Chemicals that may cause inflammation to the skin or other mucous membranes. Irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC
(2)InChI: InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-5-9(12-4)6-8-13/h9,12H,5-8H2,1-4H3
(3)InChIKey: CZYUGTLMFHDODF-UHFFFAOYSA-N
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