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2-(2-isopropyl-5-methylphenoxy)acetic acid
Weight208.257 g/mol
FormulaC12H16O3
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds4

2-(2-isopropyl-5-methylphenoxy)acetic acid (5333-40-4)

(2-isopropyl-5-methylphenoxy)acetic acid  ·  5333-40-4

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Alternate Names

  • (2-isopropyl-5-methylphenoxy)acetic acid
  • 5333-40-4
  • SMILES
    CC1=CC(=C(C=C1)C(C)C)OCC(=O)O
  • InChIKey
    MURZAHIYMVFXCF-UHFFFAOYSA-N

Estimated Properties

Boiling Point 287.52 C EPA T.E.S.T.
Boiling Point 331.38 C EPI Suite
Density 1.07 g/cm3 EPA T.E.S.T.
Flash Point 126.16 C EPA T.E.S.T.
Melting Point 102.66 C EPI Suite
Water Solubility 379.11 mg/L EPA T.E.S.T.
Water Solubility 194.88 mg/L EPI Suite

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Synthesis

THYMOL  +  chloroacetic acid (Williamson ether)
3-Methylphenoxyacetic acid  +  2-CHLOROPROPANE (Friedel-Crafts alkylation)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of 2-(2-isopropyl-5-methylphenoxy)acetic acid ›

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