(R)-1-(2,6-dichlorophenyl)ethanamine

Base Information

• Chemical Name: (R)-1-(2,6-dichlorophenyl)ethanamine
• CAS No.: 1131737-05-7
• Molecular Formula: C8H10Cl3N
• Molecular Weight: 226.5346
• Mol file: 1131737-05-7.mol

Synonyms:(R)-1-(2,6-dichlorophenyl)ethanamine;1131737-05-7;(1R)-1-(2,6-dichlorophenyl)ethanamine;(1R)-1-(2,6-dichlorophenyl)ethan-1-amine;(1R)-1-(2,6-DICHLOROPHENYL)ETHYLAMINE;SCHEMBL14121241;NRWOZHOHRZOVDA-RXMQYKEDSA-N;MFCD06762211;(R)-1-(2,6-dichlorophenyl)ethan-1-amine;CS-0451375;EN300-1967101;A894467

Chemical Property of (R)-1-(2,6-dichlorophenyl)ethanamine

Chemical Property:

• PSA: 26.02000
• LogP: 4.51540
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 189.0112047
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

99%, ^*data from raw suppliers

(R)-1-(2,6-Dichlorophenyl)ethanaminehydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=C(C=CC=C1Cl)Cl)N
• Isomeric SMILES: C[C@H](C1=C(C=CC=C1Cl)Cl)N

Technology Process of (R)-1-(2,6-dichlorophenyl)ethanamine

There total 11 articles about (R)-1-(2,6-dichlorophenyl)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: 32.0%

1-(2-Chloro-phenyl)-ethylamine (39959-67-6,68285-26-7,127733-42-0,127852-23-7) → 1-(2,6-dichlorophenyl)ethan-1-amine (1131737-05-7,172699-35-3)

Guidance literature:

With copper diacetate; palladium diacetate; copper dichloride; In acetic acid; at 100 ℃; for 14h;

DOI:10.1055/a-1625-9095

Reference yield:

(1S)-N-Trimethylsilyl-1-(2-chlorophenyl)ethylamine (121443-78-5) → (1S)-(-)-1-(2,6-Dichlorophenyl)ethylamine (121443-79-6,1131737-05-7,172699-35-3)

Guidance literature:

With n-butyllithium; hexachloroethane; Yield given. Multistep reaction; 1.) ether, hexane, 0 deg C, 40 min, 2.) ether, hexane, -40 deg C, 1 h;

DOI:10.1021/ja00195a044

Reference yield:

(S)-1-phenyl-ethylamine (2627-86-3) → (1S)-(-)-1-(2,6-Dichlorophenyl)ethylamine (121443-79-6,1131737-05-7,172699-35-3)

Guidance literature:

Multi-step reaction with 4 steps

1: 86 percent / (NH₄)2SO₄ / 1.) 100 deg C, 5 h; 125 deg C, 19 h, 2.) TMSCl was added to complete conversion at 25 deg C, then 125 deg C, 12 h

2: 1.) n-BuLi, 2.) hexachloroethane / 1.) ether, hexane, 25 deg C, 24 h, 2.) ether, hexane, -40 deg C, 1 h

3: 83 percent / (NH₄)2SO₄ / 1.) 100 deg C, 5 h; 125 deg C, 19 h, 2.) TMSCl was added to complete conversion at 25 deg C, then 125 deg C, 12 h

4: 1.) n-BuLi, 2.) hexachloroethane / 1.) ether, hexane, 0 deg C, 40 min, 2.) ether, hexane, -40 deg C, 1 h

With ammonium sulfate; n-butyllithium; hexachloroethane;

DOI:10.1021/ja00195a044

upstream raw materials:

(1S)-N-Trimethylsilyl-1-(2-chlorophenyl)ethylamine

(S)-1-phenyl-ethylamine

(S)-α-(o-chlorophenyl)ethylamine

N-<(S)-1-phenylethyl>(trimethylsilyl)amine

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