Cas no 17086-21-4 (Ethanone,1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]-)

Ethanone,1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]- structure
17086-21-4 structure
Product Name:Ethanone,1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]-
CAS No:17086-21-4
MF:C10H12O4
MW:196.199883460999
CID:142275
PubChem ID:28256
Update Time:2025-04-19

Ethanone,1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]-
    • 1-[2-hydroxy-4-(2-hydroxyethoxy)phenyl]ethanone
    • 2'-HYDROXY-4'-(2-HYDROXYETHOXY) ACETOPHENONE
    • CHEMBL187170
    • DTXSID20274847
    • 17086-21-4
    • Inchi: 1S/C10H12O4/c1-7(12)9-3-2-8(6-10(9)13)14-5-4-11/h2-3,6,11,13H,4-5H2,1H3
    • InChI Key: NUHWDRNFGDYOBG-UHFFFAOYSA-N
    • SMILES: O(CCO)C1C=CC(C(C)=O)=C(C=1)O

Computed Properties

  • Exact Mass: 196.07356
  • Monoisotopic Mass: 196.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 193
  • 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: 1.3
  • Topological Polar Surface Area: 66.8?2

Experimental Properties

  • PSA: 66.76
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