Cas no 883749-85-7 ([3-(4-Benzyloxy-phenyl)-isoxazol-5-yl]-methanol)

[3-(4-Benzyloxy-phenyl)-isoxazol-5-yl]-methanol structure
883749-85-7 structure
Product Name:[3-(4-Benzyloxy-phenyl)-isoxazol-5-yl]-methanol
CAS No:883749-85-7
MF:C17H15NO3
MW:281.305904626846
CID:2195069
Update Time:2023-08-07

[3-(4-Benzyloxy-phenyl)-isoxazol-5-yl]-methanol Chemical and Physical Properties

Names and Identifiers

    • [3-(4-Benzyloxy-phenyl)-isoxazol-5-yl]-methanol
    • DGKCQPUUTYTKBY-UHFFFAOYSA-N
    • 3-(4-benzyloxyphenyl)isoxazol-5-yl methanol
    • [3-(4-benzyloxy-phenyl)-isoxazole-5-yl]-methanol
    • Inchi: 1S/C17H15NO3/c19-11-16-10-17(18-21-16)14-6-8-15(9-7-14)20-12-13-4-2-1-3-5-13/h1-10,19H,11-12H2
    • InChI Key: DGKCQPUUTYTKBY-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1C=CC(=CC=1)C1C=C(CO)ON=1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 298
  • Topological Polar Surface Area: 55.5
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