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CAS 1117-79-9

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3-Chlorooctane

Description:
3-Chlorooctane is an organic compound classified as an alkyl halide, specifically a chlorinated hydrocarbon. Its molecular formula is C8H17Cl, indicating it consists of eight carbon atoms, seventeen hydrogen atoms, and one chlorine atom. This compound features a straight-chain structure with the chlorine atom attached to the third carbon of the octane chain, which influences its physical and chemical properties. 3-Chlorooctane is typically a colorless to pale yellow liquid at room temperature, exhibiting a characteristic odor. It is relatively hydrophobic, making it insoluble in water but soluble in organic solvents. The presence of the chlorine atom introduces reactivity, allowing it to participate in nucleophilic substitution reactions, which are common for alkyl halides. 3-Chlorooctane can be used in various applications, including as an intermediate in organic synthesis and in the production of other chemical compounds. Safety precautions should be taken when handling this substance, as it may pose health risks through inhalation or skin contact.
Formula:C8H17Cl
InChI:InChI=1/C8H17Cl/c1-3-5-6-7-8(9)4-2/h8H,3-7H2,1-2H3
InChI key:InChIKey=FYNJWLOOBINARS-UHFFFAOYSA-N
SMILES:C(CCCCC)(CC)Cl
Synonyms:
  • Octane, 3-chloro-
  • 3-Chlorooctane
  • 214-253-1
  • 3-chloro-octan
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