104-16-5

Basic information

• Product Name: 1-(3-Chloropropyl)-4-methylpiperazine
• Synonyms: 1-(3-chloropropyl)-4-methyl-piperazin;n-methylpiperazinopropyl chloride;3-(4-Methylpiperazino)propyl chloride;N-(3-Chloropropyl)-N'-methylpiperazine;1-(3-Chloropropyl)-4-methylpiperazine;1-Chloro-3-(4-Methyl-1-piperazinyl)propane;1-Methyl-4-(3-chloropropyl)piperazine;1-(3-Chloroprop-1-yl)-4-methylpiperazine
• CAS NO: 104-16-5
• Molecular Formula: C₈H₁₇ClN₂
• Molecular Weight: 176.69
• EINECS: 203-181-6
• Product Categories: Heterocycles;Intermediates;Miscellaneous Reagents
• Mol File: 104-16-5.mol
• Article Data: 17

Chemical Properties

• Melting Point: 128-130 °C(Solv: acetone (67-64-1))
• Boiling Point: 243 ºC
• Flash Point: 101 ºC
• Appearance: /
• Density: 1.015
• Vapor Pressure: 0.033mmHg at 25°C
• Refractive Index: 1.476
• Storage Temp.: Sealed in dry,Store in freezer, under -20°C
• PKA: 7?+-.0.10(Predicted)
• CAS DataBase Reference: 1-(3-Chloropropyl)-4-methylpiperazine(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(3-Chloropropyl)-4-methylpiperazine(104-16-5)
• EPA Substance Registry System: 1-(3-Chloropropyl)-4-methylpiperazine(104-16-5)

Safety Data

• Hazardous Substances Data: 104-16-5(Hazardous Substances Data)

Usage

Description

1-(3-Chloropropyl)-4-methylpiperazine is an organic compound with the molecular formula C10H22ClN, characterized by its piperazine core and chloropropyl functional group. It is a versatile building block in the synthesis of various pharmaceutically active compounds due to its unique structural features and reactivity.

Uses

Used in Pharmaceutical Industry:
1-(3-Chloropropyl)-4-methylpiperazine is used as a key intermediate for the synthesis of various pharmaceutically active compounds, such as antiulcer agents, antitumor agents, antibiotics, and anxiolytics. Its structural diversity and reactivity make it a valuable component in the development of new drugs with improved therapeutic properties.
Used in Antitumor Applications:
1-(3-Chloropropyl)-4-methylpiperazine is used as a reactant in the synthesis of pyrimidines, which serve as novel sigma-1 receptor antagonists. These antagonists are being investigated for their potential in treating neuropathic pain, offering a new approach to managing this debilitating condition.

InChI:InChI=1/C8H17ClN2/c1-10-5-7-11(8-6-10)4-2-3-9/h2-8H2,1H3

Upstream product

• 109-01-3 1-methyl-piperazine 
• 109-70-6 1.3-chlorobromopropane 

Downstream Products

• 84-97-9 Perazin 
• 1420-55-9 thiethylperazine 
• 52172-19-7 7-Hydroxyprochlorperazin 
• 54241-02-0 8-Hydroxyprochlorperazin 
• 52172-20-0 7,8-Dihydroxyprochlorperazin 
• 1053-74-3 2-acetil-10-<3'-(4''-metilpiperazin-1''-il)>propilfenotiazina 
• 13386-34-0 6-chloro-1-[3-(4-methyl-piperazin-1-yl)-propyl]-4-phenyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one 
• 4016-94-8 7-chloro-1-[3-(4-methyl-piperazin-1-yl)-propyl]-5-phenyl-1,5-dihydro-benzo[e][1,4]oxazepin-2-one 
• 128992-14-3 1-{3-[1-(4-Chloro-phenyl)-5-(4-fluoro-phenyl)-1H-[1,2,4]triazol-3-yloxy]-propyl}-4-methyl-piperazine; hydrochloride 
• 128992-13-2 1-{3-[5-(4-Chloro-phenyl)-1-(4-fluoro-phenyl)-1H-[1,2,4]triazol-3-yloxy]-propyl}-4-methyl-piperazine; hydrochloride 
• 93699-33-3 1-(2-methoxyphenyl)-1-{4-[3-(4-methylpiperazin-1-yl)-propoxy]-phenyl}-propan-1-ol 
• 98455-00-6 3-(4-methylpiperazino)propylthiol 

Relevant articles and documents

Thiourea and thiosemicarbazide derivatives: Structure, transformations, and pharmacological activity. Hepatoprotective effect of triazino- and imidazoindoles

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Synthesis and trazodone-like pharmacological profile of 1- and 2--propyl>benzotriazoles

A series of 1- and 2--propyl>benzotriazoles were prepared and evaluated for their trazodone-like pharmacological profile; as preliminary pharmacological screening, the compounds were tested for their antiserotonergic, antiadrenergic and antihistaminic in vitro activity as well as for their analgesic in vivo action.Structure-activity relationships showed that among the synthesized compounds, the analogues bearing on the 4-piperazine nitrogen either an unsubstituted phenyl ring or a 2- or 3-chloro phenyl moiety show a pharmacological profilesimilar to that of the antidepressant trazodone. benzotriazoles / antiserotonergic / antiadrenergic / antihistaminic/ analgesic

Zinc mediated alkylation of cyclic secondary amines

Zinc metal mediated simple and efficient alkylation of cyclic secondary amines e.g., piperazines and morpholine with allyl bromide, chlorobromo propane and p-methoxy benzyl bromide is described in good yields.

NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF

A compound represented by Formula [1] (in the formula, Z1 represents N, CH, or the like; X1 represents NH or the like; R1 represents a heteroaryl group or the like; each of R2, R3, and R4 represents a hydrogen atom, a halogen atom, an alkoxy group, or the like; and R5 represents a heteroaryl group or the like) or salt thereof.