Cas no 1366234-03-8 (5-Amino-6-fluoro-1,3-benzodioxole)

5-Amino-6-fluoro-1,3-benzodioxole structure
1366234-03-8 structure
Product Name:5-Amino-6-fluoro-1,3-benzodioxole
CAS No:1366234-03-8
MF:C7H6FNO2
MW:155.126445293427
CID:2083983
PubChem ID:66800372
Update Time:2024-11-04

5-Amino-6-fluoro-1,3-benzodioxole Chemical and Physical Properties

Names and Identifiers

    • 5-Amino-6-fluoro-1,3-benzodioxole
    • (6-Fluoro-1,3-benzodioxol-5-yl)amine
    • SY029694
    • 6-fluoro-1,3-benzodioxol-5-amine
    • AKOS022716087
    • 1366234-03-8
    • SCHEMBL789208
    • DTXSID001301445
    • AC2153
    • DB-229325
    • MFCD22069751
    • MDL: MFCD22069751
    • Inchi: 1S/C7H6FNO2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3,9H2
    • InChI Key: BGTDUEVUUXOUIS-UHFFFAOYSA-N
    • SMILES: FC1=CC2=C(C=C1N)OCO2

Computed Properties

  • Exact Mass: 155.03825660g/mol
  • Monoisotopic Mass: 155.03825660g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 155
  • 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: 44.5
  • XLogP3: 1.2

Experimental Properties

  • Density: 1.448±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 256.1±40.0 oC (760 Torr),
  • Flash Point: 108.7±27.3 oC,
  • Solubility: Very slightly soluble (0.59 g/l) (25 o C),

5-Amino-6-fluoro-1,3-benzodioxole Pricemore >>

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