Product Name

  • Name

    1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride

  • EINECS 258-038-0
  • CAS No. 52605-52-4
  • Article Data4
  • CAS DataBase
  • Density
  • Solubility 3.9g/L at 28℃
  • Melting Point 198-203 °C(lit.)
  • Formula C13H18Cl2N2.HCl
  • Boiling Point 395.8 °C at 760 mmHg
  • Molecular Weight 309.666
  • Flash Point 193.2 °C
  • Transport Information
  • Appearance off-white solid
  • Safety 26-37/39-24/25
  • Risk Codes 36/37/38-20/21/22
  • Molecular Structure Molecular Structure of 52605-52-4 (1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride)
  • Hazard Symbols IrritantXi,HarmfulXn
  • Synonyms Piperazine,1-(3-chlorophenyl)-4-(3-chloropropyl)-, monohydrochloride (9CI);
  • PSA 6.48000
  • LogP 3.89580

Synthetic route

1-(3-chlorophenyl)piperazine hydrochloride
13078-15-4

1-(3-chlorophenyl)piperazine hydrochloride

1,3-chlorobromopropane
109-70-6

1,3-chlorobromopropane

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

Conditions
ConditionsYield
Stage #1: 1-(3-chlorophenyl)piperazine hydrochloride; 1.3-chlorobromopropane With tetrabutylammomium bromide; potassium carbonate In acetonitrile for 0.0111111h; Microwave irradiation;
Stage #2: With hydrogenchloride In 1,4-dioxane; acetone Solvent;
88%
ice-H2 O

ice-H2 O

1-(3-chlorophenyl)piperazine hydrochloride
13078-15-4

1-(3-chlorophenyl)piperazine hydrochloride

1,3-chlorobromopropane
109-70-6

1,3-chlorobromopropane

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

Conditions
ConditionsYield
With sodium hydroxide In hydrogenchloride; water; acetone55.6%
3-chloropropanaldehyde
19434-65-2

3-chloropropanaldehyde

1-(3-chlorophenyl)piperazine hydrochloride
13078-15-4

1-(3-chlorophenyl)piperazine hydrochloride

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

Conditions
ConditionsYield
Stage #1: 3-chloropropanaldehyde; 1-(3-chlorophenyl)piperazine hydrochloride In dichloromethane for 0.25h; Inert atmosphere;
Stage #2: With sodium tris(acetoxy)borohydride In dichloromethane Inert atmosphere;
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
6969-71-7

[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

trazodone
19794-93-5

trazodone

Conditions
ConditionsYield
With sodium hydroxide In isopropyl alcohol for 26h; Reagent/catalyst; Inert atmosphere; Reflux;92%
With tetrabutylammomium bromide; potassium carbonate In acetonitrile for 0.0222222h; Time; Microwave irradiation;92%
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

1-(3-chlorophenyl)-4-(3-hydrazinopropyl)piperazine

1-(3-chlorophenyl)-4-(3-hydrazinopropyl)piperazine

Conditions
ConditionsYield
With hydrazine In isopropyl alcohol85%
5-ethyl-4-(2-phenoxyethyl)-2H-1,2,4-triazol-3(4H)-one
95885-13-5

5-ethyl-4-(2-phenoxyethyl)-2H-1,2,4-triazol-3(4H)-one

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

nefazadone
83366-66-9

nefazadone

Conditions
ConditionsYield
With sodium hydroxide In isopropyl alcohol for 7h; Heating;84%
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

1,2,4-triazolo<4,3-a>pyridin-3(2H)-one sodium salt

1,2,4-triazolo<4,3-a>pyridin-3(2H)-one sodium salt

trazodone hydrochloride
25332-39-2

trazodone hydrochloride

Conditions
ConditionsYield
With tetrabutylammomium bromide; sodium carbonate In isopropyl alcohol at 80 - 85℃; for 12h; Reagent/catalyst;83%
daidzein
486-66-8

daidzein

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

daidzein 7-ω-(3"-chlorophenylpiperozine)-4-N-propyl ether
640275-96-3

daidzein 7-ω-(3"-chlorophenylpiperozine)-4-N-propyl ether

Conditions
ConditionsYield
With potassium carbonate In DMF (N,N-dimethyl-formamide) at 80℃; for 4h;68.2%
1,5,6,7-tetrahydro-indol-4-one
13754-86-4

1,5,6,7-tetrahydro-indol-4-one

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

1-{3-[4-(3-chlorophenyl)piperazine-1-yl]propyl}-1,5,6,7-tetrahydroindol-4-one
496921-70-1

1-{3-[4-(3-chlorophenyl)piperazine-1-yl]propyl}-1,5,6,7-tetrahydroindol-4-one

Conditions
ConditionsYield
With hydrogenchloride; sodium hydroxide In 1,4-dioxane; dichloromethane; dimethyl sulfoxide
With hydrogenchloride; sodium hydroxide In 1,4-dioxane; dichloromethane; dimethyl sulfoxide
Stage #1: 1,5,6,7-tetrahydro-indol-4-one With sodium hydroxide In dimethyl sulfoxide at 25℃; for 0.25h;
Stage #2: 1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride In dimethyl sulfoxide
With hydrogenchloride; sodium hydroxide In 1,4-dioxane; dichloromethane; dimethyl sulfoxide
5-(2Methyl-1,4-dixolan-2yl)-4-(2-phenoxyethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

5-(2Methyl-1,4-dixolan-2yl)-4-(2-phenoxyethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

potassium carbonate
584-08-7

potassium carbonate

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

2-(3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl)-5-(2-methyl-1,4-dioxolan-2-yl)-2,4-dihydro-4-(2-phenoxyethyl)-3H-1,2,4-triazol-3-one

2-(3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl)-5-(2-methyl-1,4-dioxolan-2-yl)-2,4-dihydro-4-(2-phenoxyethyl)-3H-1,2,4-triazol-3-one

Conditions
ConditionsYield
With sodium hydroxide; Ki In acetonitrile
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

2-(3-[4-(3-chlorophenyl)-1-piperazinyl]propyl)-4-(2-phenoxyethyl)-4H-1,2,4-triazole-3,5(1H,2H)-dione hydrochloride
153707-87-0

2-(3-[4-(3-chlorophenyl)-1-piperazinyl]propyl)-4-(2-phenoxyethyl)-4H-1,2,4-triazole-3,5(1H,2H)-dione hydrochloride

Conditions
ConditionsYield
With hydrogenchloride; sodium hydroxide In methanol; water; isopropyl alcohol10.21 g (47%)
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

1-(3-chlorophenyl)piperazine hydrochloride
13078-15-4

1-(3-chlorophenyl)piperazine hydrochloride

1,3-chlorobromopropane
109-70-6

1,3-chlorobromopropane

4-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one

4-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Conditions
ConditionsYield
With sodium hydroxide In hydrogenchloride; water; acetone
theophylline
58-55-9

theophylline

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

C20H25ClN6O2
58215-79-5

C20H25ClN6O2

Conditions
ConditionsYield
With sodium carbonate In tetrahydrofuran for 2h; Reflux;
7-hydroxy-3,4-dihydro-2-(1H)-quinolinone
22246-18-0

7-hydroxy-3,4-dihydro-2-(1H)-quinolinone

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

7-{3-[4-(3-chlorophenyl)-1-piperazinyl]propoxy}-3,4-dihydrocarbostyril
72722-66-8

7-{3-[4-(3-chlorophenyl)-1-piperazinyl]propoxy}-3,4-dihydrocarbostyril

Conditions
ConditionsYield
With sodium methylate In methanol Reflux;
Cyclohexanethiol
1569-69-3

Cyclohexanethiol

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

ClH*C19H29ClN2S

ClH*C19H29ClN2S

Conditions
ConditionsYield
Stage #1: Cyclohexanethiol With sodium hydroxide In tetrahydrofuran for 1h; Inert atmosphere; Reflux;
Stage #2: 1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride In tetrahydrofuran for 4h; Reflux; Inert atmosphere;
sodium phenylselenide
23974-72-3

sodium phenylselenide

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

1-(3-chlorophenyl)-4-(3-phenylseleno propyl)piperazine hydrochloride

1-(3-chlorophenyl)-4-(3-phenylseleno propyl)piperazine hydrochloride

Conditions
ConditionsYield
at 20℃;
1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride
52605-52-4

1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride

[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
6969-71-7

[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

trazodone hydrochloride
25332-39-2

trazodone hydrochloride

Conditions
ConditionsYield
Stage #1: 1-(3-chloropropyl)-4-(3-chlorophenyl)piperazine hydrochloride; [1,2,4]triazolo[4,3-a]pyridin-3(2H)-one With tetrabutylammomium bromide; potassium carbonate In acetonitrile Microwave irradiation;
Stage #2: With hydrogenchloride In 1,4-dioxane; acetone

1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride Chemical Properties

Molecular Structure of 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride (CAS NO.52605-52-4):

IUPAC Name: 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride 
Empirical Formula: C13H19Cl3N2
Molecular Weight: 309.6624
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 3.24 Å2
Flash Point: 193.2 °C
Enthalpy of Vaporization: 64.6 kJ/mol
Boiling Point: 395.8 °C at 760 mmHg
Vapour Pressure: 1.79E-06 mmHg at 25°C
Melting point: 198-203 °C(lit.)
Smiles
N1(c2cc(Cl)ccc2)CCN(CC1)CCCCl.Cl
EINECS: 258-038-0
Product Categories: Piperidines, Piperidones, Piperazines; Piperazine derivates; Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Piperazines; PiperazinesHeterocyclic Building Blocks

1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride Safety Profile

Hazard Codes: IrritantXi,HarmfulXn
Risk Statements: 36/37/38-20/21/22
R36/37/38:Irritating to eyes, respiratory system and skin. 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-37/39-24/25
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S37/39:Wear suitable gloves and eye/face protection. 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
F: 10-21

1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride Specification

  1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride , with CAS number of 52605-52-4, can be called piperazine, 1-(3-chlorophenyl)-4-(3-chloropropyl)-, hydrochloride (1:1) ; 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine hydrochloride (1:1) .

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