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CAS 139013-68-6

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(3S)-4-Chloro-1,3-butanediol

Description:
(3S)-4-Chloro-1,3-butanediol is a chemical compound characterized by its specific stereochemistry and functional groups. It features a butanediol backbone with two hydroxyl (-OH) groups and a chlorine atom substituted at the fourth carbon position. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in water and polar organic solvents due to the presence of hydroxyl groups, which enhance its hydrophilicity. The chlorine atom introduces additional reactivity, making it a potential intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. The stereochemistry indicated by the (3S) designation suggests that it has specific spatial arrangements that can influence its biological activity and interactions. Safety data should be consulted for handling, as halogenated compounds can pose health risks. Overall, (3S)-4-Chloro-1,3-butanediol is a versatile compound with applications in various chemical processes.
Formula:C4H9ClO2
InChI:InChI=1S/C4H9ClO2/c5-3-4(7)1-2-6/h4,6-7H,1-3H2/t4-/m0/s1
InChI key:InChIKey=IQDXPPKWNPMHJI-BYPYZUCNSA-N
SMILES:[C@H](CCO)(CCl)O
Synonyms:
  • (2S)-4-Chloro-1,3-butanediol
  • (3S)-4-Chloro-1,3-butanediol
  • (3S)-4-Chlorobutane-1,3-diol
  • 1,3-Butanediol, 4-chloro-, (S)-
  • 1,3-butanediol, 4-chloro-, (3S)-
  • (S)-4-Chloro-1,3-butanediol
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