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CAS No.: | 174561-11-6 |
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Name: | 1-(4-Fluorobenzyl)-4-(2-hydroxyethyl)piperazine |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C13H19FN2O |
Molecular Weight: | 238.305 |
Synonyms: | BUTTPARK 46\04-32;2-[4-(4-FLUOROBENZYL)PIPERAZINO]ETHAN-1-OL;1-(4-Fluorobenzyl)-4-(2-hydroxyethyl)piperazine 97%;1-(4-Fluorobenzyl)-4-(2-hydroxyethyl)piperazine97%; |
Density: | 1.155 g/cm3 |
Melting Point: | 55 °C |
Boiling Point: | 356 °C at 760 mmHg |
Flash Point: | 169.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 22 |
PSA: | 26.71000 |
LogP: | 0.81140 |
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The 1-(4-Fluorobenzyl)-4-(2-hydroxyethyl)piperazine, with the CAS registry number 174561-11-6, is also known as 1-Piperazineethanol, 4-[(4-fluorophenyl)methyl]-. This chemical's molecular formula is C13H19FN2O and molecular weight is 238.301163. Its IUPAC name is called 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethanol. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of 1-(4-Fluorobenzyl)-4-(2-hydroxyethyl)piperazine: (1)ACD/LogP: 0.71; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.549; (6)Molar Refractivity: 65.6 cm3; (7)Molar Volume: 206.1 cm3; (8)Surface Tension: 44.2 dyne/cm; (9)Density: 1.155 g/cm3; (10)Flash Point: 169.1 °C; (11)Enthalpy of Vaporization: 63.44 kJ/mol; (12)Boiling Point: 356 °C at 760 mmHg; (13)Vapour Pressure: 1.1E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(CCN1CCO)CC2=CC=C(C=C2)F
(2)InChI: InChI=1S/C13H19FN2O/c14-13-3-1-12(2-4-13)11-16-7-5-15(6-8-16)9-10-17/h1-4,17H,5-11H2
(3)InChIKey: KCZHNDKCJQKXCG-UHFFFAOYSA-N