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(3,5-dimethylphenoxy)acetic acid
Weight180.203 g/mol
FormulaC10H12O3
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds3

(3,5-dimethylphenoxy)acetic acid (5406-14-4)

5406-14-4

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Alternate Names

  • 5406-14-4
  • SMILES
    CC1=CC(=CC(=C1)OCC(=O)O)C
  • InChIKey
    NIPZZANLNKBKIS-UHFFFAOYSA-N

Estimated Properties

Boiling Point 290.29 C EPA T.E.S.T.
Boiling Point 312.88 C EPI Suite
Density 1.16 g/cm3 EPA T.E.S.T.
Flash Point 133.64 C EPA T.E.S.T.
Melting Point 92.67 C EPI Suite
Water Solubility 855.03 mg/L EPA T.E.S.T.
Water Solubility 1193.2 mg/L EPI Suite

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Synthesis

3,5-DIMETHYLPHENOL  +  chloroacetic acid (Williamson ether)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of (3,5-dimethylphenoxy)acetic acid ›

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