2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride

Base Information Edit

Chemical Name:2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride
CAS No.:88301-74-0
Molecular Formula:C8H7ClF3N.ClH
Molecular Weight:246.059
Hs Code.:
DSSTox Substance ID:DTXSID80537884
Mol file:88301-74-0.mol

Synonyms:88301-74-0;DTXSID80537884;2-(Chloromethyl)-6-(trifluoromethyl)aniline--hydrogen chloride (1/1)

Suppliers and Price of 2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride Edit

Chemical Property:

Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:244.9985891
Heavy Atom Count:14
Complexity:171

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C(=C1)C(F)(F)F)N)CCl.Cl

Technology Process of 2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride

There total 5 articles about 2-(Chloromethyl)-6-(trifluoromethyl)aniline;hydrochloride 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: 92.0%

: 88301-75-1
2-(methylsulfinylmethyl)-6-(trifluoromethyl)-aniline

: 88301-74-0
2-(Chloromethyl)-6-(trifluoromethyl)anilinium Chloride

Guidance literature:: With hydrogenchloride; In 1,2-dichloro-ethane; at 50 ℃;
DOI:10.1007/s00044-019-02415-4

Reference yield:

: 88301-96-6
2-{(methylthio)methyl}-6-(trifluoromethyl)aniline

: 88301-74-0
2-(Chloromethyl)-6-(trifluoromethyl)anilinium Chloride

Guidance literature:: With chlorine; Yield given. Multistep reaction; 1) 1,2 dichloroethane, ice bath, 1h 2) 60-65 deg C, HCl gas, 15min;
DOI:10.1021/jo00198a025

Reference yield:

: 88-17-5
2-(trifluoromethyl)benzenamine

: 88301-74-0
2-(Chloromethyl)-6-(trifluoromethyl)anilinium Chloride

Guidance literature:: Multi-step reaction with 3 steps

1: 70 percent / N-chlorosuccinimide, triethylamine / CH₂Cl₂ / Heating

2: 86.9 percent / 40percent peracetic acid / CH₂Cl₂ / 0 °C

3: 90 percent / HCl gas / 1,2-dichloro-ethane / 5 h / 50 °C

With hydrogenchloride; peracetic acid; N-chloro-succinimide; triethylamine; In dichloromethane; 1,2-dichloro-ethane;
DOI:10.1021/jo00198a025