Cas no 187682-18-4 (Benzenemethanol, 4-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-)

Benzenemethanol, 4-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]- structure
187682-18-4 structure
Product Name:Benzenemethanol, 4-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-
CAS No:187682-18-4
MF:C13H18O3
MW:222.280224323273
CID:1379859
PubChem ID:67139706
Update Time:2025-04-20

Benzenemethanol, 4-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanol, 4-[[(tetrahydro-2H-pyran-2-yl)oxy]methyl]-
    • [4-(oxan-2-yloxymethyl)phenyl]methanol
    • SCHEMBL1732484
    • DTXSID90736503
    • 4-(tetrahydro-2h-pyran-2-yloxymethyl)benzyl alcohol
    • SODNLOGCPXYAEK-UHFFFAOYSA-N
    • [4-(tetrahydro-2-pyranyloxymethyl)phenyl]methanol
    • 187682-18-4
    • (4-((tetrahydro-2H-pyran-2-yloxy)methyl)phenyl)methanol
    • (4-{[(Oxan-2-yl)oxy]methyl}phenyl)methanol
    • DB-086207
    • Inchi: 1S/C13H18O3/c14-9-11-4-6-12(7-5-11)10-16-13-3-1-2-8-15-13/h4-7,13-14H,1-3,8-10H2
    • InChI Key: SODNLOGCPXYAEK-UHFFFAOYSA-N
    • SMILES: O1CCCCC1OCC1C=CC(CO)=CC=1

Computed Properties

  • Exact Mass: 222.12564
  • Monoisotopic Mass: 222.125594432g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 188
  • 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: 1.5
  • Topological Polar Surface Area: 38.7?2

Experimental Properties

  • PSA: 38.69
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