Cas no 393174-96-4 (Benzenemethanol, 4-[(11-hydroxyundecyl)oxy]-)

Benzenemethanol, 4-[(11-hydroxyundecyl)oxy]- structure
393174-96-4 structure
Product Name:Benzenemethanol, 4-[(11-hydroxyundecyl)oxy]-
CAS No:393174-96-4
MF:C18H30O3
MW:294.429006099701
CID:1504608
PubChem ID:71350816
Update Time:2025-04-21

Benzenemethanol, 4-[(11-hydroxyundecyl)oxy]- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanol, 4-[(11-hydroxyundecyl)oxy]-
    • 11-[4-(hydroxymethyl)phenoxy]undecan-1-ol
    • 393174-96-4
    • DTXSID20776598
    • Inchi: 1S/C18H30O3/c19-14-8-6-4-2-1-3-5-7-9-15-21-18-12-10-17(16-20)11-13-18/h10-13,19-20H,1-9,14-16H2
    • InChI Key: PCAOFKZAVMPRFV-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(CO)=CC=1)CCCCCCCCCCCO

Computed Properties

  • Exact Mass: 294.2196
  • Monoisotopic Mass: 294.21949481g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 13
  • Complexity: 213
  • 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: 4.5
  • Topological Polar Surface Area: 49.7?2

Experimental Properties

  • PSA: 49.69
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