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CAS 4427-56-9

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Isothymol

Description:
Isothymol, with the CAS number 4427-56-9, is a monoterpenoid compound that is structurally related to thymol, which is derived from thyme oil. It is characterized by its aromatic properties and is typically found in essential oils of various plants. Isothymol exhibits antimicrobial and antifungal activities, making it of interest in both food preservation and medicinal applications. The compound is a colorless to pale yellow liquid with a characteristic odor, and it is soluble in organic solvents but has limited solubility in water. Its chemical structure includes a hydroxyl group, contributing to its reactivity and potential interactions with biological systems. Isothymol is also studied for its potential therapeutic effects, including anti-inflammatory and antioxidant properties. As with many organic compounds, safety and handling precautions are essential, as it may cause irritation upon contact with skin or mucous membranes. Overall, isothymol represents a valuable compound in both natural product chemistry and applied sciences.
Formula:C10H14O
InChI:InChI=1S/C10H14O/c1-7(2)9-6-8(3)4-5-10(9)11/h4-7,11H,1-3H3
InChI key:InChIKey=DSTPUJAJSXTJHM-UHFFFAOYSA-N
SMILES:C(C)(C)C1=C(O)C=CC(C)=C1
Synonyms:
  • 1-Hydroxy-4-methyl-2-isopropylbenzene
  • 2-Isopropyl-4-methylphenol
  • 4-Methyl-2-(1-methylethyl)phenol
  • 4-Methyl-2-(Propan-2-Yl)Phenol
  • 4-Methyl-2-isopropylphenol
  • Ai3-01514
  • Brn 1860557
  • Isothymol
  • Nsc 62110
  • Phenol, 2-isopropyl-4-methyl-
  • See more synonyms
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