Cas no 669726-38-9 (2-(2-Isopropylphenoxy)-2-methylpropanoic acid)

2-(2-Isopropylphenoxy)-2-methylpropanoic acid structure
669726-38-9 structure
Product Name:2-(2-Isopropylphenoxy)-2-methylpropanoic acid
CAS No:669726-38-9
MF:C13H18O3
MW:222.280224323273
CID:1074883
PubChem ID:1532492
Update Time:2025-04-20

2-(2-Isopropylphenoxy)-2-methylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(2-Isopropylphenoxy)-2-methylpropanoic acid
    • 2-(2-Isopropyl-phenoxy)-2-methyl-propionic acid
    • 2-methyl-2-[2-(methylethyl)phenoxy]propanoic acid
    • 2-methyl-2-[2-(propan-2-yl)phenoxy]propanoic acid
    • AC1LTGYK
    • CTK5C5475
    • MolPort-000-889-604
    • SBB018178
    • F97986
    • 2-methyl-2-(2-propan-2-ylphenoxy)propanoic Acid
    • 669726-38-9
    • MFCD03422289
    • CS-0313930
    • AKOS000104048
    • VS-03811
    • 2-(2-isopropylphenoxy)-2-methylpropanoicacid
    • DTXSID10364180
    • BBL013396
    • ALBB-000913
    • STK317932
    • MDL: MFCD03422289
    • Inchi: 1S/C13H18O3/c1-9(2)10-7-5-6-8-11(10)16-13(3,4)12(14)15/h5-9H,1-4H3,(H,14,15)
    • InChI Key: SUUDZJXMAQKEGM-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1C(C)C)C(C(=O)O)(C)C

Computed Properties

  • Exact Mass: 222.12564
  • Monoisotopic Mass: 222.126
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 246
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • Density: 1.07
  • Boiling Point: 335.2°C at 760 mmHg
  • Flash Point: 121.6°C
  • Refractive Index: 1.514
  • PSA: 46.53

2-(2-Isopropylphenoxy)-2-methylpropanoic acid Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

2-(2-Isopropylphenoxy)-2-methylpropanoic acid Pricemore >>

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