Cas no 102790-36-3 (1,2-oxazol-4-ylmethanol)

1,2-oxazol-4-ylmethanol structure
1,2-oxazol-4-ylmethanol structure
Product Name:1,2-oxazol-4-ylmethanol
CAS No:102790-36-3
MF:C4H5NO2
MW:99.0880010128021
MDL:MFCD06738912
CID:125277
PubChem ID:12905097
Update Time:2024-11-04

1,2-oxazol-4-ylmethanol Chemical and Physical Properties

Names and Identifiers

    • 4-Isoxazolemethanol
    • 1,2-oxazol-4-ylmethanol
    • 4-Hydroxymethylisoxazole
    • 4-HYDROXYMETHYL-ISOXAZOLE,
    • Isoxazol-4-yl-methanol
    • isoxazole-4-methanol
    • AKOS PAO-1565
    • 102790-36-3
    • 4-Hydroxymethyl-Isoxazole
    • AKOS003674012
    • FT-0749754
    • MFCD06738912
    • (1,2-Oxazol-4-yl)methanol
    • DTXSID70512620
    • SY224250
    • YUXAURUEOIQGKA-UHFFFAOYSA-N
    • EN300-365442
    • isoxazol-4-ylmethanol
    • BB 0257756
    • CS-W000734
    • PB14463
    • A19547
    • DB-003492
    • MDL: MFCD06738912
    • Inchi: 1S/C4H5NO2/c6-2-4-1-5-7-3-4/h1,3,6H,2H2
    • InChI Key: YUXAURUEOIQGKA-UHFFFAOYSA-N
    • SMILES: O1C=C(C=N1)CO

Computed Properties

  • Exact Mass: 99.03200
  • Monoisotopic Mass: 99.032028402g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 57.7
  • 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: -0.5
  • Topological Polar Surface Area: 46.3?2

Experimental Properties

  • Boiling Point: 212.785℃ at 760 mmHg
  • PSA: 46.26000
  • LogP: 0.16690

1,2-oxazol-4-ylmethanol Pricemore >>

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