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1-Hydroxyethylethoxypiperazine

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Name

1-Hydroxyethylethoxypiperazine

EINECS 1533716-785-6
CAS No. 13349-82-1 Density 1.077 g/cm3
PSA 44.73000 LogP -0.83280
Solubility N/A Melting Point N/A
Formula C8H18N2O2 Boiling Point 267.139 °C at 760 mmHg
Molecular Weight 174.243 Flash Point 115.362 °C
Transport Information N/A Appearance yellow-brown oil
Safety 26-37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 13349-82-1 (1-Hydroxyethylethoxypiperazine) Hazard Symbols IrritantXi
Synonyms

1-[2-(2-Hydroxyethoxy)ethyl]piperazine;1-[2-[(2-Hydroxyethyl)oxy]ethyl]piperazine;2-[2-(1-Piperazinyl)ethoxy]ethanol;N-Hydroxyethoxyethylpiperazine;3-(Piperazin-1-yloxy)butan-2-ol;1-(2-(2-Hydroxyethoxy)Ethyl)Piperazine);

Article Data 12

1-Hydroxyethylethoxypiperazine Synthetic route

110-85-0

piperazine

628-89-7

2-(2-Chloroethoxy)ethanol

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

Conditions
ConditionsYield
With piperazine dihydrochloride In ethanol for 10h; Reflux; Large scale;95.1%
at 120 - 140℃; for 1h;70%
166388-52-9

tert-butyl 4-(2-(2-hydroxyethoxy)ethyl)piperazine-1-carboxylate

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

Conditions
ConditionsYield
With trifluoroacetic acid In dichloromethane at 20℃; for 2h;95%
With trifluoroacetic acid In dichloromethane at 20℃; for 1h;80%

C17H34N4O4S

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

Conditions
ConditionsYield
With dipotassium peroxodisulfate at 30 - 60℃; for 6h; Reagent/catalyst;80.5%
120-43-4

4-ethoxycarbonylpiperazine

628-89-7

2-(2-Chloroethoxy)ethanol

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

Conditions
ConditionsYield
With potassium hydroxide; ethanol
111974-69-7

Quetiapine

A

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

B

2-[2-(4,5-dihydro-1H-imidazol-1-yl)ethoxy]ethanol

C

1216996-50-7

2-[2-(1-oxidopiperazin-1-yl)ethoxy]ethanol

D

257-15-8

dibenzo[b,f]-1,4-thiazepine

E

Quetiapine sulfoxide

Conditions
ConditionsYield
In methanol at 25℃; for 6h; Kinetics; UV-irradiation;
111-42-2

2,2'-iminobis[ethanol]

929-06-6

2-(2-Aminoethoxy)ethanol

13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

Conditions
ConditionsYield
With hydrogen at 180℃; under 150015 Torr; for 15h;
With hydrogen at 180℃; under 750.075 - 150015 Torr; Time;
With hydrogen at 180℃; under 150015 Torr; for 15h;
13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

1067884-35-8

(2′Z-3′E)-6-bromoindirubin-3′-[O-(2-bromoethyl)oxime]

1067884-49-4

(2'Z-3'E)-6-bromoindirubin-3'-[O-(2-{4-[2-(2-hydroxyethoxy)-ethyl]piperazin-1-yl}ethyl)oxime]

Conditions
ConditionsYield
In N,N-dimethyl-formamide at 50℃;100%
13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

107-13-1

acrylonitrile

1278584-73-8

3-{4-[2-(2-hydroxy-ethoxy)ethyl]-piperazin-1-yl}-propionitrile

Conditions
ConditionsYield
at 20℃; for 72h; Michael addition;100%
13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

13745-86-3

11-chloro-dibenzo[b,f][1,4]thiazepine

111974-69-7

Quetiapine

Conditions
ConditionsYield
In toluene at 105 - 107℃;99%
In toluene at 110 - 120℃; for 8h; Product distribution / selectivity;98%
In toluene Reflux;92%
13349-82-1

1-[2-(2-hydroxyethoxy)ethyl]piperazine

1027727-66-7

(S)-N-[(3-bromo-propyl)(oxido)phenyl-λ4-sulfanylidene]-5-({3-[(3-methyl-2-furoyl)amino]phenyl}ethynyl)nicotinamide

1027727-68-9

(S)-N-[(3-{4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl}propyl)(oxido)phenyl-λ4-sulfanylidene]-5-({3-[(3-methyl-2-furoyl)amino]phenyl}ethynyl)nicotinamide

Conditions
ConditionsYield
In N,N-dimethyl-formamide at 80℃; for 0.5h;96%

1-Hydroxyethylethoxypiperazine Specification

1-Hydroxyethylethoxypiperazine, with the CAS number of 13349-82-1, can be called 2-butanol, 3-(1-piperazinyloxy)-; 3-(Piperazin-1-yloxy)butan-2-ol. It belongs to the categories of  Piperidine; Piperidines, Piperidones, Piperazines; Piperazine derivates; API intermediates; (intermediate of quadipine); (intermediate of quetiapine fumarate); Miscellaneous Reagents; Intermediates of Quetiapine. It is a yellow-brown oil,can be used as quetiapine intermediate.

Physical properties about 1-Hydroxyethylethoxypiperazine are: (1)ACD/LogP: 0.183; (2)ACD/LogD (pH 5.5): -2.62; (3)ACD/LogD (pH 7.4): -1.04; (4)ACD/BCF (pH 5.5): 1.00; (5)ACD/BCF (pH 7.4): 1.00; (6)ACD/KOC (pH 5.5): 1.00; (7)ACD/KOC (pH 7.4): 1.79; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.503; (12)Molar Refractivity: 47.804 cm3; (13)Molar Volume: 161.842 cm3; (14)Polarizability: 18.951 10-24cm3; (15)Surface Tension: 40.6640014648438 dyne/cm; (16)Density: 1.077 g/cm3; (17)Flash Point: 115.362 °C; (18)Enthalpy of Vaporization: 58.658 kJ/mol; (19)Boiling Point: 267.139 °C at 760 mmHg; (20)Vapour Pressure: 0.00100000004749745 mmHg at 25°C

When you are using this chemical, please be cautious about it as the following:
1. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice;
2. Wear suitable gloves and eye/face protection;

You can still convert the following datas into molecular structure:
(1)InChI=1S/C8H18N2O2/c11-6-8-12-7-5-10-3-1-9-2-4-10/h9,11H,1-8H2;
(2)InChIKey=FLNQAPQQAZVRDA-UHFFFAOYSA-N;
(3)SmilesN1(CCOCCO)CCNCC1

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