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HomeProduct name list2,4,5-Trichloropyrimidine

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: 2024-08-21 22:41:43
2,4,5-Trichloropyrimidine Structural

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  n20/D 1.574(lit.)
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)
ghs
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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