Cas no 62402-52-2 (Propanoic acid, 2-[4-(hydroxyphenylmethyl)phenoxy]-2-methyl-)

Propanoic acid, 2-[4-(hydroxyphenylmethyl)phenoxy]-2-methyl- structure
62402-52-2 structure
Product Name:Propanoic acid, 2-[4-(hydroxyphenylmethyl)phenoxy]-2-methyl-
CAS No:62402-52-2
MF:C17H18O4
MW:286.322425365448
CID:446031
PubChem ID:12346118
Update Time:2025-04-19

Propanoic acid, 2-[4-(hydroxyphenylmethyl)phenoxy]-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • Propanoic acid, 2-[4-(hydroxyphenylmethyl)phenoxy]-2-methyl-
    • 2-[4-[hydroxy(phenyl)methyl]phenoxy]-2-methylpropanoic acid
    • DTXSID70492771
    • 62402-52-2
    • 2-{4-[Hydroxy(phenyl)methyl]phenoxy}-2-methylpropanoic acid
    • Inchi: 1S/C17H18O4/c1-17(2,16(19)20)21-14-10-8-13(9-11-14)15(18)12-6-4-3-5-7-12/h3-11,15,18H,1-2H3,(H,19,20)
    • InChI Key: PCHVMVBMOYTJCU-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CC=1)C(C1C=CC=CC=1)O)C(C(=O)O)(C)C

Computed Properties

  • Exact Mass: 286.12054
  • Monoisotopic Mass: 286.12050905g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 339
  • 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: 66.8?2

Experimental Properties

  • PSA: 66.76
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