2,6-Dichlorophenethylamine

Base Information

• Chemical Name: 2,6-Dichlorophenethylamine
• CAS No.: 14573-23-0
• Molecular Formula: C8H9Cl2N
• Molecular Weight: 190.072
• Hs Code.: 29214990
• European Community (EC) Number: 624-034-6
• DSSTox Substance ID: DTXSID50370124
• Wikidata: Q72467223
• Pharos Ligand ID: RZ2J8QLGHBKX
• ChEMBL ID: CHEMBL510649
• Mol file: 14573-23-0.mol

Synonyms:2,6-Dichlorophenethylamine;14573-23-0;2-(2,6-dichlorophenyl)ethanamine;2-(2,6-dichlorophenyl)ethan-1-amine;2-(2,6-dichlorophenyl)ethylamine;Benzeneethanamine, 2,6-dichloro-;CHEMBL510649;MFCD00060612;2,6-Dichloro-beta-phenylethylamine;2-(2,6-dichloro-phenyl)-ethylamine;2-(2-Aminoethyl)-1,3-dichlorobenzene;SCHEMBL1570203;DTXSID50370124;ACIMQXSSGMWVKG-UHFFFAOYSA-N;2,6-Dichlorophenethylamine, 97%;HMS3746E19;CS-B1736;BDBM50262799;AKOS000160986;1-Amino-2-(2,6-dichlorophenyl)ethane;AS-31078;PD128580;SY016995;D2926;FT-0676385;EN300-52968;J-008143;2,6-Dichloro--phenylethylamine

Chemical Property of 2,6-Dichlorophenethylamine

Chemical Property:

• Appearance/Colour: clear colorless to slightly yellow liquid
• Vapor Pressure: 0.00865mmHg at 25°C
• Refractive Index: n20/D 1.5690(lit.)
• Boiling Point: 266.419 °C at 760 mmHg
• PKA: 9.19±0.10(Predicted)
• Flash Point: 114.927 °C
• PSA: 26.02000
• Density: 1.269 g/cm³
• LogP: 3.19490
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 189.0112047
• Heavy Atom Count: 11
• Complexity: 109

Purity/Quality:

97% ^*data from raw suppliers

2,6-Dichlorophenethylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi, T
• Hazard Codes: Xi,T
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)CCN)Cl
• Uses: 2,6-Dichlorophenethylamine, a phenethylamine derivative, may be used to synthesize C-terminal phenethylamine peptide analog.

Technology Process of 2,6-Dichlorophenethylamine

There total 4 articles about 2,6-Dichlorophenethylamine 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:

2,6-dichloronitrostyrene (52287-52-2,22482-43-5) → 2-(2,6-dichlorophenyl)ethylamine (14573-23-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; Reflux;

DOI:10.2174/1570180815666180801120440

Reference yield:

2,6-dichlorophenylacetonitrile (3215-64-3) → 2-(2,6-dichlorophenyl)ethylamine (14573-23-0)

Guidance literature:

With diborane; In tetrahydrofuran;

DOI:10.1021/jm00315a024

Reference yield:

2,6-dichlorobenzaldehyde (83-38-5) → 2-(2,6-dichlorophenyl)ethylamine (14573-23-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 44 percent / NH₄OAc / toluene / 22 h / Heating

2: 58 percent / LiAlH₄ / diethyl ether / 3 h / Ambient temperature

With lithium aluminium tetrahydride; ammonium acetate; In diethyl ether; toluene;

upstream raw materials:

2,6-dichlorophenylacetonitrile

2,6-dichlorobenzaldehyde

2,6-dichloronitrostyrene

Downstream raw materials:

1-(2,6-dichlorophenethyl)guanidine

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