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CAS 2855-08-5

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1-Chloro-3,3-dimethylbutane

Description:
1-Chloro-3,3-dimethylbutane is an organic compound characterized by its structure, which features a chlorine atom attached to a tertiary carbon in a branched alkane framework. It belongs to the class of alkyl halides, specifically chlorinated hydrocarbons. The molecular formula of this compound is C₅H₁₁Cl, indicating it contains five carbon atoms, eleven hydrogen atoms, and one chlorine atom. This compound is typically a colorless liquid at room temperature and has a relatively low boiling point compared to larger alkanes due to the presence of the chlorine atom, which influences its physical properties. 1-Chloro-3,3-dimethylbutane is known for its reactivity, particularly in nucleophilic substitution reactions, where the chlorine atom can be replaced by various nucleophiles. It is used in organic synthesis and as an intermediate in the production of other chemical compounds. Safety precautions should be taken when handling this substance, as it may pose health risks if inhaled or ingested, and proper storage conditions are necessary to maintain its stability.
Formula:C6H13Cl
InChI:InChI=1/C12H14O/c1-8-3-4-9(2)11(7-8)12(13)10-5-6-10/h3-4,7,10H,5-6H2,1-2H3
InChI key:InChIKey=XGCKOSFYXBAPQM-UHFFFAOYSA-N
SMILES:C(C(C)(C)C)CCl
Synonyms:
  • 3,3-Dimethylbutyl chloride
  • 4-Chloro-2,2-dimethylbutane
  • Butane, 1-chloro-3,3-dimethyl-
  • Cyclopropyl(2,5-Dimethylphenyl)Methanone
  • NSC 76580
  • Neohexyl chloride
  • 1-Chloro-3,3-dimethylbutane
  • TERT-BUTYLCHLOROETHYLENE
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