Name | 2',4'-Dichloroacetophenone |
Synonyms | 2',4'-Dichloroacetop 2,4-Dicloro actophenone Ketoconazole Impurity 5 2,4-Dichloracetophenone 2',4'-Dichloroacetophenone 1-(2,4-dichlorophenyl)-ethanon Methyl 2,4-dichlorophenyl ketone |
CAS | 2234-16-4 |
EINECS | 218-780-8 |
InChIKey | XMCRWEBERCXJCH-UHFFFAOYSA-N |
Molecular Formula | C8H6Cl2O |
Molar Mass | 189.04 |
Density | 1.304g/cm3 |
Melting Point | 29-34℃ |
Boling Point | 246.7°C at 760 mmHg |
Flash Point | 100.9°C |
Water Solubility | ca. 200 mg/L |
Vapor Presure | 0.0268mmHg at 25°C |
Appearance | Form Solid, color Colorless to yellow-brown |
Storage Condition | Sealed in dry,Room Temperature |
Refractive Index | 1.548 |
MDL | MFCD00000581 |
Physical and Chemical Properties | Density 1.32 melting point 29-34°C boiling point 242°C refractive index 1.5635 flash point 131°C water-soluble ca. 200 mg/L |
Use | Used as a pharmaceutical intermediate for the synthesis of ketoconazole drugs |
Hazard Symbols | Xn - Harmful |
Risk Codes | R22 - Harmful if swallowed R52/53 - Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. |
Safety Description | S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. |
WGK Germany | 2 |
TSCA | Yes |
HS Code | 29143990 |
storage conditions | Sealed in dry,Room Temperature |
morphology | Solid |
color | Colorless to yellow-brown |
water solubility | ca. 200 mg/L |
BRN | 637819 |
InChIKey | XMCRWEBERCXJCH-UHFFFAOYSA-N |
NIST chemical information | Ethanone, 1-(2,4-dichlorophenyl)-(2234-16-4) |
EPA chemical information | 2',4'-Dichloroacetophenone (2234-16-4) |
WGK Germany | 2 |
Hazard Note | Irritant |
TSCA | Yes |
customs code | 29143990 |
Chemical properties
2,4-dichloroacetophenone is white crystal, m.p.33 ~ 34 ℃, B. p.128 ~ 131 ℃/2.4kpa,n20D 1.5635, insoluble in water, soluble in benzene, toluene, alcohol and other organic solvents.
Uses
1,2, 4-dichloroacetophenone is the raw material for preparing & omega;-bromo -2,4-dichloroacetophenone or & omega;-2,4-trichloroacetophenone, the latter two It is an intermediate for the preparation of fungicides such as imazazole, propiconazole, and acyclazole, as well as an intermediate for insecticide poison and her.
2. Used as a pharmaceutical intermediate for the synthesis of ketoconazole drugs
3. Intermediate of ketoconazole.
Production method
The preparation method is to add m-dichlorobenzene into the reaction bottle, raise the temperature to 50 ℃, add an appropriate amount of anhydrous aluminum trichloride under stirring, keep the temperature at 50 ℃, add acetyl chloride dropwise, gradually raise the temperature to 100 ℃ after dropping, and stir at this temperature for 8h. After the reaction is over, add dichloromethane into the reaction solution and pour it into water, place, the organic layer was washed with water, dried, evaporated to the solvent and distilled under reduced pressure, and the fraction of 160~180 ℃/0.015 MPa was collected to obtain a white crystal of 2,4-dichloroacetophenone.