Cas no 63480-14-8 (methyl 2-amino-5-chloro-4-methylbenzoate)

Methyl 2-amino-5-chloro-4-methylbenzoate is a benzoate ester derivative featuring both amino and chloro substituents on its aromatic ring. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Its distinct substitution pattern enhances reactivity in electrophilic aromatic substitution and coupling reactions, making it valuable for constructing complex molecular frameworks. The presence of the methyl ester group offers versatility for further functionalization, including hydrolysis or transesterification. The compound’s stability under standard conditions ensures consistent performance in synthetic applications. Its well-defined structure and purity are critical for reproducibility in research and industrial processes.
methyl 2-amino-5-chloro-4-methylbenzoate structure
63480-14-8 structure
Product Name:methyl 2-amino-5-chloro-4-methylbenzoate
CAS No:63480-14-8
MF:C9H10ClNO2
MW:199.634201526642
MDL:MFCD20714900
CID:4086833
PubChem ID:85898545
Update Time:2025-05-27

methyl 2-amino-5-chloro-4-methylbenzoate Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-amino-5-chloro-4-methyl-, methyl ester
    • Methyl 2-amino-5-chloro-4-methylbenzoate
    • 2-Amino-5-chloro-4-methyl-benzoic acid methyl ester
    • DTXSID201277078
    • Methyl2-amino-5-chloro-4-methylbenzoate
    • 63480-14-8
    • MFCD20714900
    • 965-133-7
    • methyl 2-amino-5-chloro-4-methylbenzoate
    • MDL: MFCD20714900
    • Inchi: 1S/C9H10ClNO2/c1-5-3-8(11)6(4-7(5)10)9(12)13-2/h3-4H,11H2,1-2H3
    • InChI Key: FBJHURWTCNZWAV-UHFFFAOYSA-N
    • SMILES: ClC1=CC(C(=O)OC)=C(C=C1C)N

Computed Properties

  • Exact Mass: 199.0400063g/mol
  • Monoisotopic Mass: 199.0400063g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 198
  • 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: 2.6
  • Topological Polar Surface Area: 52.3?2

methyl 2-amino-5-chloro-4-methylbenzoate Pricemore >>

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