5-Amino-4,6-dichloropyrimidine
- CAS NO.：5413-85-4
- Empirical Formula: C4H3Cl2N3
- Molecular Weight: 163.99
- MDL number: MFCD00006108
- EINECS: 226-503-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-04-23 13:52:06
What is 5-Amino-4,6-dichloropyrimidine?
Chemical properties
Yellowish-brown crystals or powder
The Uses of 5-Amino-4,6-dichloropyrimidine
5-Amino-4,6-dichloropyrimidine was used in the synthesis of:
- oxepane ring containing monocyclic, conformationally restricted bicyclic and spirocyclic nucleosides
- conformationally locked bicyclo[2.2.1]heptane/oxa-bicyclo[3.2.1]octane nucleosides
- N(7)-substituted purines
- chiral derivatives of (+)-erythro-9-(2-hydroxy-3-nonyl)adenine
- 9-alkyl-6-substituted-purine analogs, potent anticonvulsant agents
- pyrimido-oxazepines in a three-step process with microwave heating at 150°C
The Uses of 5-Amino-4,6-dichloropyrimidine
An intermediate in the production of many biological inhibitors.
Properties of 5-Amino-4,6-dichloropyrimidine
| Melting point: | 145-148 °C (lit.) |
| Boiling point: | 270.44°C (rough estimate) |
| Density | 1.6662 (rough estimate) |
| refractive index | 1.6300 (estimate) |
| storage temp. | 2-8°C |
| solubility | slightly soluble |
| form | Crystals or Powder |
| pka | -3.01±0.26(Predicted) |
| color | Yellow-brown |
| Water Solubility | slightly soluble |
| Sensitive | Moisture Sensitive |
| BRN | 126885 |
| CAS DataBase Reference | 5413-85-4(CAS DataBase Reference) |
| NIST Chemistry Reference | 5-Amino-4,6-dichloropyrimidine(5413-85-4) |
| EPA Substance Registry System | 5-Pyrimidinamine, 4,6-dichloro- (5413-85-4) |
Safety information for 5-Amino-4,6-dichloropyrimidine
| 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 5-Amino-4,6-dichloropyrimidine
| InChIKey | NIGDWBHWHVHOAD-UHFFFAOYSA-N |
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