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CAS No.: | 211053-48-4 |
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Name: | 2-(4-methylpiperazin-2-yl)ethanol |
Molecular Structure: | |
Formula: | C7H16N2O |
Molecular Weight: | 144.217 |
Synonyms: | 2-(4-methylpiperazin-2-yl)ethanol;2-Piperazineethanol,4-methyl-(9CI);2-(4-Methylpiperazin-2-yl)ethan-1-ol |
Density: | 0.97 g/cm3 |
Boiling Point: | 253.7 °C at 760 mmHg |
Flash Point: | 107.2 °C |
PSA: | 35.50000 |
LogP: | -0.46090 |
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This chemical is called 2-Piperazineethanol,4-methyl-, and its systematic name is 2-(4-methylpiperazin-2-yl)ethanol. With the molecular formula of C7H16N2O, its molecular weight is 144.21. The CAS registry number of the chemical is 211053-48-4. Additionally, its product category is Aminetertiary.
Other characteristics of 2-Piperazineethanol,4-methyl- can be summarised as followings: (1)ACD/LogP: 0.02; (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: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 35.5 Å2; (11)Index of Refraction: 1.462; (12)Molar Refractivity: 40.93 cm3; (13)Molar Volume: 148.6 cm3; (14)Polarizability: 16.22×10-24cm3; (15)Surface Tension: 30.8 dyne/cm; (16)Density: 0.97 g/cm3; (17)Flash Point: 107.2 °C; (18)Enthalpy of Vaporization: 57.05 kJ/mol; (19)Boiling Point: 253.7 °C at 760 mmHg; (20)Vapour Pressure: 0.00277 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CN1CC(CCO)NCC1
2.InChI: InChI=1/C7H16N2O/c1-9-4-3-8-7(6-9)2-5-10/h7-8,10H,2-6H2,1H3
3.InChIKey: OIIMSDKCNRHEQQ-UHFFFAOYAD
4.Std. InChI: InChI=1S/C7H16N2O/c1-9-4-3-8-7(6-9)2-5-10/h7-8,10H,2-6H2,1H3
5.Std. InChIKey: OIIMSDKCNRHEQQ-UHFFFAOYSA-N