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Weight100.161 g/mol
FormulaC6H12O
Hydrogen Acceptors1
Hydrogen Donors0
Aromatic Rings0
Rotatable Bonds4

Hexanal (66-25-1)

caproic aldehyde  ·  n-hexanal  ·  (E)-2-hexanal

Score: #734 in Biology , #797 in Chemistry
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Areas of Application

Safety

  • H226: Flammable liquid and vapor
    Warning Flammable liquids - Category 3
  • H319: Causes serious eye irritation
    Warning Serious eye damage/eye irritation - Category 2A
  • H402: Harmful to aquatic life
    Hazardous to the aquatic environment, acute hazard - Category 3

Trends

Alternate Names

  • caproic aldehyde
  • n-hexanal
  • (E)-2-hexanal
  • (Z)-hex-3-enal
  • E-2-hexanal
  • capronaldehyde
  • hexanaldehyde
  • SMILES
    CCCCCC=O
  • InChIKey
    JARKCYVAAOWBJS-UHFFFAOYSA-N

Estimated Properties

Boiling Point 129.98 C EPA T.E.S.T.
Density 0.83 g/cm3 EPA T.E.S.T.
Flash Point 36.91 C EPA T.E.S.T.
Water Solubility 4440.47 mg/L EPA T.E.S.T.

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Synthesis

1-Hexanol  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
2-HEXANOL  +  Oxalyl chloride (Swern oxidation)
Synthesis of Hexanal ›

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