Cas no 869782-97-8 (6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid)

6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid structure
869782-97-8 structure
Product Name:6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid
CAS No:869782-97-8
MF:C9H5F3N2O3
MW:246.142812490463
MDL:MFCD06739136
CID:719077
PubChem ID:29921548
Update Time:2024-10-26

6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Trifluoromethoxy-3-indazolecarboxylic acid
    • 1H-Indazole-3-carboxylicacid, 6-(trifluoromethoxy)-
    • 6-(TRIFLUOROMETHOXY)-3-INDAZOLE CARBOXYLIC ACID,
    • 6-Trifluoromethoxy-1H-indazole-3-carboxylic acid
    • 6-(trifluoromethoxy)-1H-indazole-3-carboxylic acid
    • 6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid
    • DBSBRTKNVSHDMD-UHFFFAOYSA-N
    • KM2457
    • AB28678
    • ST24045537
    • V8248
    • AM20041273
    • BB 0260860
    • 6-(Trifluoromethoxy)1
    • 6-(Trifluoromethoxy)-1H-indazole-3-carboxylic acid (ACI)
    • AKOS023166122
    • MFCD06739136
    • CS-0040218
    • DB-076796
    • 6-(Trifluoromethoxy)1H-indazole-3-carboxylic acid
    • AKOS015902311
    • 6-Trifluoromethoxy-3-indazolecarboxylicacid
    • 869782-97-8
    • DTXSID30652137
    • AS-31088
    • SCHEMBL2856373
    • SY020628
    • Z1171157835
    • EN300-76470
    • MDL: MFCD06739136
    • Inchi: 1S/C9H5F3N2O3/c10-9(11,12)17-4-1-2-5-6(3-4)13-14-7(5)8(15)16/h1-3H,(H,13,14)(H,15,16)
    • InChI Key: DBSBRTKNVSHDMD-UHFFFAOYSA-N
    • SMILES: O=C(C1C2C(=CC(=CC=2)OC(F)(F)F)NN=1)O

Computed Properties

  • Exact Mass: 246.025
  • Monoisotopic Mass: 246.025
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 310
  • 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: 75.2
  • XLogP3: 2.6

Experimental Properties

  • Color/Form: Pale-yellow to Yellow-brown Solid
  • Density: 1.7±0.1 g/cm3
  • Melting Point: 261-263 °C
  • Boiling Point: 401.9℃ at 760 mmHg
  • Flash Point: 196.8±27.3 °C
  • Refractive Index: 1.6
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid Security Information

6-(trifluoromethoxy)-2H-indazole-3-carboxylic acid Pricemore >>

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