Cas no 161790-50-7 (2-(2-Methylphenoxy)butanoic Acid)

2-(2-Methylphenoxy)butanoic Acid structure
161790-50-7 structure
Product Name:2-(2-Methylphenoxy)butanoic Acid
CAS No:161790-50-7
MF:C11H14O3
MW:194.227063655853
CID:1068121
PubChem ID:4281982
Update Time:2025-04-20

2-(2-Methylphenoxy)butanoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-(o-Tolyloxy)butanoic acid
    • 2-(2-Methylphenoxy)butanoic acid
    • 2-o-Tolyloxy-butyric acid
    • AC1N7NC8
    • ARONIS007248
    • CTK4D0958
    • MolPort-000-889-539
    • SBB009320
    • SureCN3879629
    • 2-(2-methylphenoxy)butyric acid
    • DTXSID00401538
    • NoName_425
    • VS-01005
    • Butanoic acid, 2-(2-methylphenoxy)-
    • G22505
    • ethyl 2-(o-tolyloxy)acetic acid
    • AKOS017259207
    • DTXSID80901324
    • IHCFDXGPIABNTN-UHFFFAOYSA-N
    • MFCD03422242
    • Z57663835
    • 2-methylphenoxybutyric acid
    • SCHEMBL3879629
    • 161790-50-7
    • AKOS000101825
    • CS-0307916
    • BBL002038
    • EN300-100861
    • STK397792
    • ALBB-000857
    • AN-329/40883718
    • HMS1704C20
    • 2-(2-Methylphenoxy)butanoic Acid
    • MDL： MFCD03422242
    • Inchi： 1S/C11H14O3/c1-3-9(11(12)13)14-10-7-5-4-6-8(10)2/h4-7,9H,3H2,1-2H3,(H,12,13)
    • InChI Key： IHCFDXGPIABNTN-UHFFFAOYSA-N
    • SMILES： O(C1C=CC=CC=1C)C(C(=O)O)CC

Computed Properties

  • Exact Mass: 194.09432
  • Monoisotopic Mass: 194.094
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 191
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 46.5A^2

Experimental Properties

  • Density: 1.114
  • Boiling Point: 309.7°C at 760 mmHg
  • Flash Point: 117.4°C
  • Refractive Index: 1.522
  • PSA: 46.53

2-(2-Methylphenoxy)butanoic Acid Pricemore >>

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