Cas no 7499-18-5 ( )

  structure
  structure
Product Name: 
CAS No:7499-18-5
MF:C10H11NO3
MW:193.199242830276
CID:980859
PubChem ID:348284
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 4-carbamoyl-2,6-dimethylbenzoic acid
    • 2,6-dimethyl-terephthalamic acid
    • 2,6-Dimethyl-terephthalamidsaeure
    • 4-Aminocarbonyl-2,6-dimethyl-benzoic Acid
    • AC1L897F
    • KB-241030
    • NSC407543
    • SureCN2430779
    • 7499-18-5
    • DTXSID10324688
    • SCHEMBL2430779
    • NSC-407543
    • AKOS024322270
    • DB-137587
    • 4-(aminocarbonyl)-2,6-dimethylbenzoic acid
    •  
    • Inchi: 1S/C10H11NO3/c1-5-3-7(9(11)12)4-6(2)8(5)10(13)14/h3-4H,1-2H3,(H2,11,12)(H,13,14)
    • InChI Key: GDVBJIJUBPFSPR-UHFFFAOYSA-N
    • SMILES: OC(C1C(C)=CC(C(N)=O)=CC=1C)=O

Computed Properties

  • Exact Mass: 193.07393
  • Monoisotopic Mass: 193.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 240
  • 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: 1.1
  • Topological Polar Surface Area: 80.4?2

Experimental Properties

  • PSA: 80.39
  • LogP: 1.80080

  Pricemore >>

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