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CAS 3972-56-3

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1-Chloro-4-(1,1-dimethylethyl)benzene

Description:
1-Chloro-4-(1,1-dimethylethyl)benzene, also known as para-tert-butylchlorobenzene, is an organic compound characterized by a chlorobenzene structure with a tert-butyl group attached to the para position of the benzene ring. It has a molecular formula of C10H13Cl and features a chlorine atom substituent, which contributes to its reactivity and potential applications in organic synthesis. This compound is typically a colorless to pale yellow liquid with a characteristic aromatic odor. It is relatively hydrophobic, exhibiting low solubility in water but good solubility in organic solvents. The presence of the tert-butyl group enhances its steric bulk, influencing its chemical reactivity and interactions with other molecules. 1-Chloro-4-(1,1-dimethylethyl)benzene is used in various chemical reactions, including nucleophilic substitutions and as an intermediate in the synthesis of other organic compounds. Safety precautions should be taken when handling this substance, as it may pose health risks if inhaled or ingested, and appropriate protective equipment is recommended.
Formula:C10H13Cl
InChI:InChI=1S/C10H13Cl/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3
InChI key:InChIKey=XRTANKYQJQXSFP-UHFFFAOYSA-N
SMILES:C(C)(C)(C)C1=CC=C(Cl)C=C1
Synonyms:
  • 1-Chloro-4-(1,1-dimethylethyl)benzene
  • 1-Chloro-4-tert-butylbenzene
  • 1-tert-Butyl-4-chlorobenzene
  • 4-Chloro-tert-butylbenzene
  • 4-tert-Butylchlorobenzene
  • 4-tert-Butylphenyl chloride
  • Benzene, 1-chloro-4-(1,1-dimethylethyl)-
  • Benzene, 1-tert-butyl-4-chloro-
  • p-Chloro-tert-butylbenzene
  • p-tert-Butylchlorobenzene
  • 4-tert-Butyl-1-chlorobenzene
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