1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-

Base Information

Chemical Name:1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-
CAS No.:107658-58-2
Molecular Formula:C₁₇H₁₁Cl₄N₃O₂
Molecular Weight:431.105
Hs Code.:
DSSTox Substance ID:DTXSID40910391
ChEMBL ID:CHEMBL10401

Synonyms:107658-58-2;1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-;CHEMBL10401;SCHEMBL11046764;DTXSID40910391;1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1,2,4-triazol-1-yl)propan-1-one;1,2-Bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propan-1-one

Suppliers and Price of 1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-

Chemical Property:

Vapor Pressure:8.56E-17mmHg at 25°C
Boiling Point:631.1°C at 760 mmHg
Flash Point:335.5°C
Density:1.55g/cm³
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:430.957587
Heavy Atom Count:26
Complexity:514

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1Cl)Cl)C(=O)C(CN2C=NC=N2)(C3=C(C=C(C=C3)Cl)Cl)O

Technology Process of 1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)-

There total 5 articles about 1-Propanone, 1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)- 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:

: 288-88-0
1,2,4-Triazole

: 94147-83-8,107680-48-8
(2,4-Dichloro-phenyl)-[(R)-2-(2,4-dichloro-phenyl)-oxiranyl]-methanone

: 94171-15-0,107658-58-2,107741-26-4
(R)-(-)-1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propan-1-one

Guidance literature:: With sodium hydride; In N,N-dimethyl-formamide; at 60 ℃; for 4h; Yield given;
DOI:10.1021/jm00389a016

Reference yield:

: 104941-05-1
1,2-Bis-(2,4-dichloro-phenyl)-propenone

: 94171-15-0,107658-58-2,107741-26-4
(R)-(-)-1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propan-1-one

Guidance literature:: Multi-step reaction with 4 steps

1: 58 percent / NaBH₄, CeCl₃*7H₂O / methanol / 0 - 5 °C

2: 38 percent / (+)-diisopropyl L-tartrate, Ti(O-i-Pr)4, t-butyl hydroperoxide / CH₂Cl₂; various solvent(s) / 15 h / -20 °C

3: 98 percent / PCC / CH₂Cl₂ / 18 h / Ambient temperature

4: NaH / dimethylformamide / 4 h / 60 °C

With titanium(IV) isopropylate; tert.-butylhydroperoxide; sodium tetrahydroborate; cerium(III) chloride; L-(+)-diisopropyl tartrate; sodium hydride; pyridinium chlorochromate; In methanol; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00389a016

Reference yield:

: 107680-34-2
2-(2,4-dichlorophenyl)-2',4'-dichloroacetophenone

: 94171-15-0,107658-58-2,107741-26-4
(R)-(-)-1,2-bis(2,4-dichlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propan-1-one

Guidance literature:: Multi-step reaction with 5 steps

1: 66 percent / acetic anhydride / 0.5 h / 50 °C

2: 58 percent / NaBH₄, CeCl₃*7H₂O / methanol / 0 - 5 °C

3: 38 percent / (+)-diisopropyl L-tartrate, Ti(O-i-Pr)4, t-butyl hydroperoxide / CH₂Cl₂; various solvent(s) / 15 h / -20 °C

4: 98 percent / PCC / CH₂Cl₂ / 18 h / Ambient temperature

5: NaH / dimethylformamide / 4 h / 60 °C

With titanium(IV) isopropylate; tert.-butylhydroperoxide; sodium tetrahydroborate; cerium(III) chloride; L-(+)-diisopropyl tartrate; sodium hydride; pyridinium chlorochromate; In methanol; dichloromethane; acetic anhydride; N,N-dimethyl-formamide;
DOI:10.1021/jm00389a016