Cas no 763893-29-4 (5,8-dimethylquinoline-3-carboxylic Acid)

5,8-dimethylquinoline-3-carboxylic Acid structure
763893-29-4 structure
Product Name:5,8-dimethylquinoline-3-carboxylic Acid
CAS No:763893-29-4
MF:C12H11NO2
MW:201.221243143082
MDL:MFCD09787777
CID:1779753
PubChem ID:329773513
Update Time:2025-04-21

5,8-dimethylquinoline-3-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 5,8-dimethylquinoline-3-carboxylic Acid
    • SureCN7681923
    • AGN-PC-002C84
    • CTK8E5139
    • AB52216
    • 3-BROMO-4-CHLORO-8-METHYLQUINOLINE
    • G64280
    • 5,8-Dimethylquinoline-3-carboxylic acid, AldrichCPR
    • SCHEMBL7681923
    • DB-075125
    • CS-0455617
    • 5,8-DIMETHYLQUINOLINE-3-CARBOXYLICACID
    • DTXSID70562887
    • 763893-29-4
    • MFCD09787777
    • MDL: MFCD09787777
    • Inchi: 1S/C12H11NO2/c1-7-3-4-8(2)11-10(7)5-9(6-13-11)12(14)15/h3-6H,1-2H3,(H,14,15)
    • InChI Key: MXKOVYWLTMCDMM-UHFFFAOYSA-N
    • SMILES: OC(C1=CN=C2C(C)=CC=C(C)C2=C1)=O

Computed Properties

  • Exact Mass: 201.07900
  • Monoisotopic Mass: 201.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 254
  • 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: 2.4
  • Topological Polar Surface Area: 50.2?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 373.9±37.0 °C at 760 mmHg
  • Flash Point: 179.9±26.5 °C
  • PSA: 50.19000
  • LogP: 2.54980
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

5,8-dimethylquinoline-3-carboxylic Acid Security Information

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