2,4,5-Trichloropyrimidine
- CAS NO.：5750-76-5
- Empirical Formula: C4HCl3N2
- Molecular Weight: 183.42
- MDL number: MFCD03788200
- EINECS: 628-281-0
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-09-25 09:23:02
What is 2,4,5-Trichloropyrimidine?
Chemical properties
Colorless to pale yellow liquid
The Uses of 2,4,5-Trichloropyrimidine
2,4,5-Trichloropyrimidine is used in the synthesis of potent and selective anaplastic lymphoma kinase (ALK-5) inhibitors, used as an anti-tumor treatment. Also used in the synthesis of EGFR inhibitors.
Properties of 2,4,5-Trichloropyrimidine
| Boiling point: | 84°C 1mm |
| Density | 1.6001 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point: | >230 °F |
| storage temp. | Inert atmosphere,Store in freezer, under -20°C |
| form | clear liquid |
| pka | -4.26±0.29(Predicted) |
| color | Colorless to Light orange to Yellow |
| Water Solubility | Not miscible or difficult to mix in water. |
| BRN | 4449 |
| InChI | InChI=1S/C4HCl3N2/c5-2-1-8-4(7)9-3(2)6/h1H |
| CAS DataBase Reference | 5750-76-5(CAS DataBase Reference) |
Safety information for 2,4,5-Trichloropyrimidine
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2,4,5-Trichloropyrimidine
| InChIKey | GIKMWFAAEIACRF-UHFFFAOYSA-N |
| SMILES | C1(Cl)=NC=C(Cl)C(Cl)=N1 |
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product: 5750-76-5 2,4,5 – TRICHLOROPYRIMIDINE 98%
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