2-(4-Isopropylpiperazin-1-yl)ethanamine

Base Information

• Chemical Name: 2-(4-Isopropylpiperazin-1-yl)ethanamine
• CAS No.: 4489-53-6
• Molecular Formula: C9 H21 N3
• Molecular Weight: 171.286
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID80406304
• Wikidata: Q82211213
• Mol file: 4489-53-6.mol

Synonyms:4489-53-6;2-(4-Isopropylpiperazin-1-yl)ethanamine;2-(4-propan-2-ylpiperazin-1-yl)ethanamine;2-[4-(Propan-2-yl)piperazin-1-yl]ethan-1-amine;MFCD06742593;2-(4-Isopropyl-piperazin-1-yl)-ethylamine;1-Piperazineethanamine,4-(1-methylethyl)-(9CI);2-(4-Isopropylpiperazin-1-yl)ethylamine;2-(4-ISOPROPYL-PIPERAZIN-1-YL)-ETHY LAMINE;SCHEMBL1307292;DTXSID80406304;AIGDWIXUUOVPGQ-UHFFFAOYSA-N;AKOS003588405;2-(4-Isopropyl-1-piperazinyl)ethanamine;2-(4-Isopropyl-1-piperazinyl)ethylamine;BS-38192;2-(4-isopropylpiperazin-1-yl)ethan-1-amine;CS-0186419;FT-0748570;P18571;2-(4-isopropylpiperazin-1-yl)ethanamine, AldrichCPR

Chemical Property of 2-(4-Isopropylpiperazin-1-yl)ethanamine

Chemical Property:

• Vapor Pressure: 0.0183mmHg at 25°C
• Boiling Point: 253.4°C at 760 mmHg
• Flash Point: 105.9°C
• PSA: 32.50000
• Density: 0.941g/cm³
• LogP: 0.54720
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 171.173547683
• Heavy Atom Count: 12
• Complexity: 117

Purity/Quality:

97% ^*data from raw suppliers

2-(4-Isopropyl-piperazin-1-yl)-ethylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)N1CCN(CC1)CCN

Technology Process of 2-(4-Isopropylpiperazin-1-yl)ethanamine

There total 4 articles about 2-(4-Isopropylpiperazin-1-yl)ethanamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(4-isopropyl-piperazin-1-yl)-acetonitrile (240143-46-8) → 2-<4-(1-methylethyl)piperazin-1-yl>ethylamine (4489-53-6)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether;

DOI:10.1021/jm981098j

Reference yield:

1-(1-methylethyl)piperazine (4318-42-7) → 2-<4-(1-methylethyl)piperazin-1-yl>ethylamine (4489-53-6)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃ / acetonitrile

2: LiAlH₄ / diethyl ether

With lithium aluminium tetrahydride; potassium carbonate; In diethyl ether; acetonitrile;

DOI:10.1021/jm981098j

Reference yield:

ethyl 4-(1-methylethyl)piperazine-1-carboxylate (61014-91-3) → 2-<4-(1-methylethyl)piperazin-1-yl>ethylamine (4489-53-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 90 percent / 45 percent HBr / 3 h / Heating

2: K₂CO₃ / acetonitrile

3: LiAlH₄ / diethyl ether

With lithium aluminium tetrahydride; hydrogen bromide; potassium carbonate; In diethyl ether; acetonitrile;

DOI:10.1021/jm981098j

upstream raw materials:

(4-isopropyl-piperazin-1-yl)-acetonitrile

1-(1-methylethyl)piperazine

ethyl 4-(1-methylethyl)piperazine-1-carboxylate

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