2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-

Base Information

• Chemical Name: 2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-
• CAS No.: 70842-05-6
• Molecular Formula: C12H10 Cl F3 N2 O2
• Molecular Weight: 306.6682
• DSSTox Substance ID: DTXSID10221087
• Wikidata: Q83098692
• ChEMBL ID: CHEMBL4750103
• Mol file: 70842-05-6.mol

Synonyms:BRN 0892220;2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-;70842-05-6;CHEMBL4750103;3-(3-Trifluormethyl-4-chlor-phenyl)-5,5-dimethyl-hydantoin [German];3-(4-Chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2,4-imidazolidinedione;3-(3-Trifluormethyl-4-chlor-phenyl)-5,5-dimethyl-hydantoin;3-(4-Chloro-3-(trifluoromethyl)phenyl)-5,5-dimethylimidazolidine-2,4-dione;C12H10ClF3N2O2;SCHEMBL11079218;DTXSID10221087;BDBM50550372;C12-H10-Cl-F3-N2-O2;LS-79146;3-(3-trifluoromethyl-4-chlorophenyl)-5,5-dimethylhydantoin;3-(3-trifluoromethyl-4-chloro-phenyl)-5,5-dimethylhydantoin

Chemical Property of 2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-

Chemical Property:

• Density: 1.414g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 306.0382897
• Heavy Atom Count: 20
• Complexity: 439

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)Cl)C(F)(F)F)C

Technology Process of 2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-

There total 4 articles about 2,4-Imidazolidinedione, 3-(4-chloro-3-(trifluoromethyl)phenyl)-5,5-dimethyl- 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: 97.0%

N-[(3-trifluoromethyl-4-chlorophenyl)-carbamoyl]-2-methylalanine methyl ester (70842-02-3) → 3-(4-chloro-3-trifluoromethyl-phenyl)-5,5-dimethyl-imidazolidine-2,4-dione (70842-05-6)

Guidance literature:

With hydrogenchloride; In acetone; Heating;

Reference yield:

α-Isocyanatobuttersaeure-methylester (54213-21-7) → 3-(4-chloro-3-trifluoromethyl-phenyl)-5,5-dimethyl-imidazolidine-2,4-dione (70842-05-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 91 percent

2: 97 percent / HCl (6N) / acetone / Heating

With hydrogenchloride; In acetone;

Reference yield:

4-chloro-3-trifluoromethyl-aniline (320-51-4) → 3-(4-chloro-3-trifluoromethyl-phenyl)-5,5-dimethyl-imidazolidine-2,4-dione (70842-05-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 91 percent

2: 97 percent / HCl (6N) / acetone / Heating

With hydrogenchloride; In acetone;

upstream raw materials:

N-[(3-trifluoromethyl-4-chlorophenyl)-carbamoyl]-2-methylalanine methyl ester

α-Isocyanatobuttersaeure-methylester

4-chloro-3-trifluoromethyl-aniline