4-(Trifluoromethyl)-1H-imidazole
- Product Name
- 4-(Trifluoromethyl)-1H-imidazole
- CAS No.
- 33468-69-8
- Chemical Name
- 4-(Trifluoromethyl)-1H-imidazole
- Synonyms
- 4-TrifluoroMethyliMidazole;EOS-60687;4(5)-(Trifluoromethyl)imidazole;4-(TRIFLUOROMETHYL)-1H-IMIDAZOLE;1H-Imidazole, 5-(trifluoromethyl)-;4-(TRIFLUOROMETHYL)-1H-IMIDAZOLE(I);4-(Trifluoromethyl)-1H-imidazole 98%
- CBNumber
- CB8763109
- Molecular Formula
- C4H3F3N2
- Formula Weight
- 136.08
- MOL File
- 33468-69-8.mol
4-(Trifluoromethyl)-1H-imidazole Property
- Melting point:
- 149-150
- Boiling point:
- 224.7±35.0 °C(Predicted)
- Density
- 1.440±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 10.29±0.10(Predicted)
- form
- Solid
- color
- White to Almost white
- InChI
- InChI=1S/C4H3F3N2/c5-4(6,7)3-1-8-2-9-3/h1-2H,(H,8,9)
- InChIKey
- DFLGRTIPTPCKPJ-UHFFFAOYSA-N
- SMILES
- C1NC(C(F)(F)F)=CN=1
Safety
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22-36/37/38-40
- Safety Statements
- 26-36/37-24/25
- Hazard Note
- Irritant
- HS Code
- 29349990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- CDS005796
- Product name
- 4-(Trifluoromethyl)-1H-imidazole
- Purity
- AldrichCPR
- Packaging
- 100MG
- Price
- $68.1
- Updated
- 2023/06/20
- Product number
- T2928
- Product name
- 4(5)-(Trifluoromethyl)imidazole
- Purity
- >98.0%(GC)(T)
- Packaging
- 1g
- Price
- $191
- Updated
- 2025/07/31
- Product number
- T790645
- Product name
- 4-Trifluoromethyl-1H-imidazole
- Packaging
- 10g
- Price
- $395
- Updated
- 2021/12/16
- Product number
- PC9869
- Product name
- 4-(Trifluoromethyl)-1H-imidazole
- Purity
- 98%
- Packaging
- 1g
- Price
- $19
- Updated
- 2021/12/16
- Product number
- 3H32-3-88
- Product name
- 4-(Trifluoromethyl)-1H-imidazole
- Purity
- 97%
- Packaging
- 1g
- Price
- $33
- Updated
- 2021/12/16
4-(Trifluoromethyl)-1H-imidazole Chemical Properties,Usage,Production
Chemical Properties
Off-white crystalline powder
Uses
4-Trifluoromethyl-1H-imidazole acts as an inhibitor of sweet almond β-glucosidase. It is used as a reagent used in the synthesis of 3-substituted 2-aminopyridines via displacement of 3-fluoro-2-nitropyridine.
Synthesis
431-35-6
77287-34-4
33468-69-8
Procedure for the synthesis of 4-(trifluoromethyl)-1H-imidazole: 3-bromo-1,1,1-trifluoropropan-2-one (25.0 g, 131 mmol, Aldrich Item No. 374059) and formamide (104 mL, 2.62 mol) were sequentially added to a 500 mL round bottom flask. The reaction mixture was slowly heated to reflux temperature (about 140 °C) and kept at reflux for 2.5 hours of reaction. Upon completion of the reaction, the mixture was cooled to room temperature, diluted with 200 mL of 10% aqueous K2CO3 solution and subsequently extracted with ether (5 x 200 mL). The organic phases were combined, washed sequentially with 10% aqueous K2CO3 (2 x 100 mL) and deionized water (2 x 100 mL), dried over anhydrous MgSO4, filtered and concentrated under reduced pressure to give a brown solid. The resulting solid was washed with dichloromethane (DCM) to finalize 4-(trifluoromethyl)-1H-imidazole (4.0 g, 22% yield) as a brown solid. The structure of the product was confirmed by 1H NMR (CD3OD): δ 7.82 (s, 1H), 7.60 (s, 1H).
References
[1] Patent: WO2010/83246, 2010, A1. Location in patent: Page/Page column 100
4-(Trifluoromethyl)-1H-imidazole Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 4-(Trifluoromethyl)-1H-imidazole manufacturers
- Product
- 4-(Trifluoromethyl)-1H-imidazole 33468-69-8
- Price
- US $500.00-190.00/g
- Min. Order
- 5g
- Purity
- 99%
- Supply Ability
- 50
- Release date
- 2024-07-12
- Product
- 4-(Trifluoromethyl)-1H-imidazole 33468-69-8
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 20T
- Release date
- 2024-08-14
- Product
- 4-(Trifluoromethyl)-1H-imidazole 33468-69-8
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 200kg
- Release date
- 2019-12-24