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CAS No.: | 416887-38-2 |
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Name: | N-(2-METHOXYETHYL)-1-METHYLPIPERIDIN-4-AMINE |
Molecular Structure: | |
Formula: | C9H20N2O |
Molecular Weight: | 172.271 |
Synonyms: | (2-Methoxyethyl)(1-methylpiperidin-4-yl)amine; |
Density: | 0.95 g/cm3 |
Boiling Point: | 228 °C at 760 mmHg |
Flash Point: | 91.7 °C |
Risk Codes: | 22 |
PSA: | 24.50000 |
LogP: | 0.64540 |
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The 4-Piperidinamine,N-(2-methoxyethyl)-1-methyl-, with the CAS registry number 416887-38-2, is also known as (2-Methoxy-ethyl)-(1-methyl-piperidin-4-yl)-amine. Its molecular formula is C9H20N2O and its product category is Aminesecondary. Additionally, its systematic name is N-(2-methoxyethyl)-1-methylpiperidin-4-amine.
Other characteristics of the 4-Piperidinamine,N-(2-methoxyethyl)-1-methyl- can be summarised as followings: (1)ACD/LogP: 0.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.91; (4)ACD/LogD (pH 7.4): -2.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 15.71 Å2; (13)Index of Refraction: 1.477; (14)Molar Refractivity: 50.92 cm3; (15)Molar Volume: 180 cm3; (16)Polarizability: 20.18×10-24cm3; (17)Surface Tension: 33.6 dyne/cm; (18)Density: 0.95 g/cm3; (19)Flash Point: 91.7 °C; (20)Enthalpy of Vaporization: 46.46 kJ/mol; (21)Boiling Point: 228 °C at 760 mmHg; (22)Vapour Pressure: 0.0751 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O(C)CCNC1CCN(C)CC1
2.InChI: InChI=1/C9H20N2O/c1-11-6-3-9(4-7-11)10-5-8-12-2/h9-10H,3-8H2,1-2H3
3.InChIKey: YZYMRSNKBLZRJK-UHFFFAOYAJ