2,3,5-Trichlorobenzylamine

Base Information

• Chemical Name: 2,3,5-Trichlorobenzylamine
• CAS No.: 101084-86-0
• Molecular Formula: C7H6 Cl3 N
• Molecular Weight: 210.49
• DSSTox Substance ID: DTXSID30697124
• Wikidata: Q82626952
• Mol file: 101084-86-0.mol

Synonyms:2,3,5-TRICHLOROBENZYLAMINE;101084-86-0;Benzenemethanamine, 2,3,5-trichloro-;SCHEMBL1764819;DTXSID30697124;1-(2,3,5-Trichlorophenyl)methanamine;A1-02039

Chemical Property of 2,3,5-Trichlorobenzylamine

Chemical Property:

• PSA: 26.02000
• LogP: 3.80580
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 208.956582
• Heavy Atom Count: 11
• Complexity: 131

Purity/Quality:

98.5% ^*data from raw suppliers

2,3,5-Trichlorobenzylamine 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1CN)Cl)Cl)Cl

Technology Process of 2,3,5-Trichlorobenzylamine

There total 5 articles about 2,3,5-Trichlorobenzylamine 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:

2,3,5-trichloro-toluene (56961-86-5) → 2,3,5-trichlorobenzylamine (101084-86-0)

Guidance literature:

Multistep reaction; (i) Br₂, (heating), (ii) hexamethylenetetramine;

Reference yield:

1-(azidomethyl)-2,3,5-trichlorobenzene → 2,3,5-trichlorobenzylamine (101084-86-0)

Guidance literature:

With water; triphenylphosphine; In tetrahydrofuran; at 20 ℃; for 18h;

DOI:10.1021/jacs.0c11056

Reference yield:

2,3,5-trichlorobenzaldehyde (56961-75-2) → 2,3,5-trichlorobenzylamine (101084-86-0)

Guidance literature:

Multi-step reaction with 3 steps

1: borane-THF / tetrahydrofuran / 3 h / 0 °C

2: diphenyl phosphoryl azide; 1,8-diazabicyclo[5.4.0]undec-7-ene / toluene / 16 h / 0 - 20 °C

3: triphenylphosphine; water / tetrahydrofuran / 18 h / 20 °C

With borane-THF; diphenyl phosphoryl azide; water; 1,8-diazabicyclo[5.4.0]undec-7-ene; triphenylphosphine; In tetrahydrofuran; toluene;

DOI:10.1021/jacs.0c11056

upstream raw materials:

2,3,5-trichloro-toluene

2,3,5-trichlorobenzaldehyde

1,2,4-Trichlorobenzene

2,3,5-trichlorophenylmethanol