Cas no 791722-05-9 (Ethyl 5-amino-2,4-dimethylbenzoate)

Ethyl 5-amino-2,4-dimethylbenzoate is a benzoate ester derivative featuring an amino group and two methyl substituents on the aromatic ring. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Its structural features, including the electron-donating amino and methyl groups, enhance reactivity in electrophilic substitution and coupling reactions. The ethyl ester moiety improves solubility in organic solvents, facilitating further derivatization. The compound’s well-defined purity and stability make it suitable for precise synthetic applications. Its consistent performance and versatility underscore its value in research and industrial processes requiring tailored benzoate frameworks.
Ethyl 5-amino-2,4-dimethylbenzoate structure
791722-05-9 structure
Product Name:Ethyl 5-amino-2,4-dimethylbenzoate
CAS No:791722-05-9
MF:C11H15NO2
MW:193.242303133011
MDL:MFCD17276487
CID:555691
PubChem ID:45089279
Update Time:2025-10-16

Ethyl 5-amino-2,4-dimethylbenzoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-amino-2,4-dimethylbenzoate
    • Benzoic acid, 5-amino-2,4-dimethyl-, ethyl ester (9CI)
    • Benzoic acid,5-amino-2,4-dimethyl-, ethyl ester
    • 791722-05-9
    • AKOS012322361
    • EN300-2775748
    • Ethyl5-amino-2,4-dimethylbenzoate
    • MDL: MFCD17276487
    • Inchi: 1S/C11H15NO2/c1-4-14-11(13)9-6-10(12)8(3)5-7(9)2/h5-6H,4,12H2,1-3H3
    • InChI Key: LOOJNVRBHRGTJS-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1C=C(C(C)=CC=1C)N)=O

Computed Properties

  • Exact Mass: 193.11
  • Monoisotopic Mass: 193.11
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 206
  • 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: 52.3A^2
  • XLogP3: 2.2

Ethyl 5-amino-2,4-dimethylbenzoate Pricemore >>

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