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CAS 1439-08-3

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5-Bromo-4-(1,1-dimethylethyl)pyrimidine

Description:
5-Bromo-4-(1,1-dimethylethyl)pyrimidine is an organic compound characterized by its pyrimidine ring, which is a six-membered heterocyclic structure containing two nitrogen atoms at positions 1 and 3. The presence of a bromine atom at the 5-position and a tert-butyl group (1,1-dimethylethyl) at the 4-position contributes to its unique chemical properties. This compound is typically a colorless to pale yellow solid and is soluble in organic solvents. It is often used in organic synthesis and pharmaceutical research due to its potential as an intermediate in the production of various biologically active compounds. The bromine substituent can participate in nucleophilic substitution reactions, making it a versatile building block in synthetic chemistry. Additionally, the tert-butyl group enhances the compound's lipophilicity, which can influence its biological activity and interaction with other molecules. Safety precautions should be taken when handling this compound, as it may pose health risks if ingested or inhaled.
Formula:C8H11BrN2
InChI:InChI=1S/C8H11BrN2/c1-8(2,3)7-6(9)4-10-5-11-7/h4-5H,1-3H3
InChI key:InChIKey=ROCULZFCNXRIKL-UHFFFAOYSA-N
SMILES:C(C)(C)(C)C=1C(Br)=CN=CN1
Synonyms:
  • Pyrimidine, 5-bromo-4-(1,1-dimethylethyl)-
  • Pyrimidine, 5-bromo-4-tert-butyl-
  • 5-Bromo-4-tert-butylpyrimidine
  • 5-Bromo-4-(1,1-dimethylethyl)pyrimidine
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