Cas no 852180-70-2 (Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)-)

Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)- structure
852180-70-2 structure
Product Name:Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)-
CAS No:852180-70-2
MF:C10H10N2O2
MW:190.198602199554
MDL:MFCD07368548
CID:719839
PubChem ID:7060550
Update Time:2025-04-19

Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)-
    • [3-(5-methyl-1,2,4-oxadiazol-3-yl)-phenyl]methanol
    • [3-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl]methanol
    • SY239086
    • CS-0317097
    • MFCD07368548
    • 3-(5-Methyl-1,24-oxadiazol-3-yl)benzyl alcohol
    • SCHEMBL1300632
    • KCLCEECIUZDIGI-UHFFFAOYSA-N
    • J-502743
    • (3-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl)methanol
    • 852180-70-2
    • ALBB-032166
    • 3-(5-Methyl-1,2,4-oxadiazol-3-yl)benzyl alcohol
    • AKOS006346247
    • DB-010147
    • AS-40018
    • DTXSID50427627
    • MDL: MFCD07368548
    • Inchi: 1S/C10H10N2O2/c1-7-11-10(12-14-7)9-4-2-3-8(5-9)6-13/h2-5,13H,6H2,1H3
    • InChI Key: KCLCEECIUZDIGI-UHFFFAOYSA-N
    • SMILES: O1C(C)=NC(C2=CC=CC(CO)=C2)=N1

Computed Properties

  • Exact Mass: 190.07400
  • Monoisotopic Mass: 190.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 189
  • 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: 1.5
  • Topological Polar Surface Area: 59.2?2

Experimental Properties

  • Density: 1.234
  • Melting Point: 56 °C
  • Boiling Point: 383.1°C at 760 mmHg
  • Flash Point: 185.5°C
  • Refractive Index: 1.57
  • PSA: 59.15000
  • LogP: 1.53730

Benzenemethanol,3-(5-methyl-1,2,4-oxadiazol-3-yl)- Security Information

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