Cas no 119162-58-2 (3-Benzyl-isoxazol-5-ylamine)

3-Benzyl-isoxazol-5-ylamine structure
3-Benzyl-isoxazol-5-ylamine structure
Product Name:3-Benzyl-isoxazol-5-ylamine
CAS No:119162-58-2
MF:C10H10N2O
MW:174.199202060699
MDL:MFCD16301537
CID:1211416
PubChem ID:60174253
Update Time:2025-04-20

3-Benzyl-isoxazol-5-ylamine Chemical and Physical Properties

Names and Identifiers

    • 3-benzylisoxazol-5-amine
    • 3-Benzyl-Isoxazol-5-Ylamine
    • 3-Benzyl-Isoxazol-5-Ylamine(WX609188)
    • EN300-1864129
    • 119162-58-2
    • 3-benzyl-1,2-oxazol-5-amine
    • Z1255417836
    • MFCD16301537
    • 3-(Phenylmethyl)-5-isoxazolamine
    • 5-Isoxazolamine, 3-(phenylmethyl)-
    • SCHEMBL1984411
    • PJEXDUCPZGTNTP-UHFFFAOYSA-N
    • STL227941
    • AKOS015996975
    • CS-0214647
    • AM806223
    • 3-Benzyl-isoxazol-5-ylamine
    • MDL: MFCD16301537
    • Inchi: 1S/C10H10N2O/c11-10-7-9(12-13-10)6-8-4-2-1-3-5-8/h1-5,7H,6,11H2
    • InChI Key: PJEXDUCPZGTNTP-UHFFFAOYSA-N
    • SMILES: O1C(=CC(CC2C=CC=CC=2)=N1)N

Computed Properties

  • Exact Mass: 174.0794
  • Monoisotopic Mass: 174.079312947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 157
  • 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: 2
  • Topological Polar Surface Area: 52?2

Experimental Properties

  • PSA: 52.05

3-Benzyl-isoxazol-5-ylamine Pricemore >>

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