Cas no 218590-81-9 (3-Amino-4-(ethoxycarbonyl)benzoic acid)

3-Amino-4-(ethoxycarbonyl)benzoic acid structure
218590-81-9 structure
Product Name:3-Amino-4-(ethoxycarbonyl)benzoic acid
CAS No:218590-81-9
MF:C10H11NO4
MW:209.198642969131
MDL:MFCD22480962
CID:243505
PubChem ID:21505195
Update Time:2025-04-19

3-Amino-4-(ethoxycarbonyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Amino-4-(ethoxycarbonyl)benzoic acid
    • 1,4-Benzenedicarboxylicacid, 2-amino-, 1-ethyl ester
    • 3-amino-4-ethoxycarbonylbenzoic acid
    • 1-ethyl 2-aminoterephthalate
    • 2-aminophenyl-1,4-dicarboxylic acid ethyl ester
    • AK100344
    • ANW-70330
    • CTK8C3622
    • SureCN559271
    • SCHEMBL559271
    • SB78515
    • 3-Amino-4-(ethoxycarbonyl)benzoicacid
    • 218590-81-9
    • DTXSID70615185
    • 1,4-Benzenedicarboxylicacid,2-amino-,1-ethylester(9CI)
    • AKOS016002654
    • MDL: MFCD22480962
    • Inchi: 1S/C10H11NO4/c1-2-15-10(14)7-4-3-6(9(12)13)5-8(7)11/h3-5H,2,11H2,1H3,(H,12,13)
    • InChI Key: ZDOVYBLUBPFNAI-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1C=CC(C(=O)O)=CC=1N)=O

Computed Properties

  • Exact Mass: 209.06880783g/mol
  • Monoisotopic Mass: 209.06880783g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • 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: 2.1
  • Topological Polar Surface Area: 89.6?2

3-Amino-4-(ethoxycarbonyl)benzoic acid Pricemore >>

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