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CAS No.: | 98275-69-5 |
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Name: | 2-Piperazinemethanol,5-methyl-(6CI,9CI) |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C6H14N2O |
Molecular Weight: | 130.19 |
Synonyms: | 5-Methylpiperazine-2-methanol;2-Piperazinemethanol,5-methyl-; |
Density: | 0.95 g/cm3 |
Boiling Point: | 238.145 °C at 760 mmHg |
Flash Point: | 113.001 °C |
PSA: | 44.29000 |
LogP: | -0.41380 |
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(5-Methyl-2-piperazinyl)methanol is an organic compound with the formula C6H14N2O, and its systematic name is the same with the product name. With the CAS registry number 98275-69-5, it is also named as 2-Piperazinemethanol,5-methyl-. It belongs to the product category of Piperazine. In addition, the molecular weight is 130.19.
Physical properties of (5-Methyl-2-piperazinyl)methanol are: (1)ACD/LogP: -1.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.47; (4)ACD/LogD (pH 7.4): -3.12; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 44.29 Å2; (13)Index of Refraction: 1.439; (14)Molar Refractivity: 36.08 cm3; (15)Molar Volume: 137.083 cm3; (16)Polarizability: 14.303×10-24cm3; (17)Surface Tension: 32.06 dyne/cm; (18)Density: 0.95 g/cm3; (19)Flash Point: 113.001 °C; (20)Enthalpy of Vaporization: 55.206 kJ/mol; (21)Boiling Point: 238.145 °C at 760 mmHg; (22)Vapour Pressure: 0.008 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OCC1CNC(C)CN1
(2)Std. InChI: InChI=1S/C6H14N2O/c1-5-2-8-6(4-9)3-7-5/h5-9H,2-4H2,1H3
(3)Std. InChIKey: ZAJCWYDHBKNPSQ-UHFFFAOYSA-N