Cas no 17012-22-5 (Methyl 4-(Acetylamino)benzoate)

Methyl 4-(Acetylamino)benzoate is a white to off-white crystalline compound with the molecular formula C??H??NO?. It is commonly used as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, dyes, and specialty chemicals. The compound features both ester and amide functional groups, offering versatility in chemical reactions such as hydrolysis, acylation, and esterification. Its stable crystalline form ensures ease of handling and storage under standard conditions. With a well-defined melting point and solubility profile, Methyl 4-(Acetylamino)benzoate is suitable for precise applications in research and industrial processes, where consistency and purity are critical.
Methyl 4-(Acetylamino)benzoate structure
17012-22-5 structure
Product Name:Methyl 4-(Acetylamino)benzoate
CAS No:17012-22-5
MF:C10H11NO3
MW:193.199242830276
MDL:MFCD00463106
CID:122032
PubChem ID:577758
Update Time:2025-06-06

Methyl 4-(Acetylamino)benzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-acetamidobenzoate
    • -ACETYLAMINO-BENZOIC ACID METHYL ESTER
    • Benzoic acid, 4-(acetylamino)-, methyl ester
    • Methyl 4-(acetylamino)benzoate
    • Methyl N-acetylaminobenzoate
    • 4-(Acetylamino)benzoic acid methyl ester
    • 4-Acetylamino-benzoic acid methyl ester
    • methyl 4-acetylaminobenzoate
    • TimTec1_002203
    • SCHEMBL863168
    • LS-12713
    • AKOS002315053
    • FT-0716446
    • L10152
    • HMS1540E03
    • EN300-263089
    • DTXSID10342009
    • CHEMBL4567643
    • QKWTXJSLAZKYGV-UHFFFAOYSA-N
    • AF-965/00542035
    • AMY10540
    • 17012-22-5
    • Methyl 4-(acetylamino)benzoate #
    • Methyl4-acetamidobenzoate
    • BRD-K86467085-001-01-9
    • CS-0116677
    • Q63398977
    • MFCD00463106
    • SY213432
    • ALBB-033470
    • DB-022354
    • STL560132
    • Methyl 4-(Acetylamino)benzoate
    • MDL: MFCD00463106
    • Inchi: 1S/C10H11NO3/c1-7(12)11-9-5-3-8(4-6-9)10(13)14-2/h3-6H,1-2H3,(H,11,12)
    • InChI Key: QKWTXJSLAZKYGV-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=CC(=CC=1)NC(C)=O)=O

Computed Properties

  • Exact Mass: 193.07393
  • Monoisotopic Mass: 193.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 219
  • 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: 1.8
  • Topological Polar Surface Area: 55.4?2

Experimental Properties

  • Density: 1.204
  • Melting Point: 127 oC
  • PSA: 55.4

Methyl 4-(Acetylamino)benzoate Pricemore >>

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