Cas no 37924-91-7 (1,2-Benzisoxazole-3-methanol,5-hydroxy-(9CI))

1,2-Benzisoxazole-3-methanol,5-hydroxy-(9CI) structure
37924-91-7 structure
Product Name:1,2-Benzisoxazole-3-methanol,5-hydroxy-(9CI)
CAS No:37924-91-7
MF:C8H7NO3
MW:165.146082162857
CID:297781
Update Time:2023-11-19

1,2-Benzisoxazole-3-methanol,5-hydroxy-(9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzisoxazole-3-methanol,5-hydroxy-
    • 5-Hydroxy-3-(hydroxymethyl)-1,2-benzisoxazole
    • 3-(hydroxymethyl)benzo[d]isoxazol-5-ol
    • CID 119090320
    • 1,2-Benzisoxazole-3-methanol,5-hydroxy-(9CI)
    • 1,2-Benzisoxazole-3-methanol, 5-hydroxy-
    • Inchi: 1S/C8H7NO3/c10-4-7-6-3-5(11)1-2-8(6)12-9-7/h1-3,10-11H,4H2
    • InChI Key: GPIZBGSHALBLOD-UHFFFAOYSA-N
    • SMILES: O1C2C=CC(=CC=2C(CO)=N1)O

Computed Properties

  • Exact Mass: 165.043
  • Monoisotopic Mass: 165.043
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 164
  • 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
  • Topological Polar Surface Area: 66.5
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