Cas no 284462-58-4 (3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester)

3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester structure
284462-58-4 structure
Product Name:3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester
CAS No:284462-58-4
MF:C13H12N2O3
MW:244.245983123779
MDL:MFCD28965406
CID:1434820
PubChem ID:22040606
Update Time:2025-04-20

3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester
    • 5-(4-aminophenoxy)nicotinic acid methyl ester
    • 284462-58-4
    • methyl5-[4-aminophenoxy]pyridine-3-carboxylate
    • methyl 5-(4-aminophenoxy)pyridine-3-carboxylate
    • SPPJUUNCUKYHSS-UHFFFAOYSA-N
    • A1-11154
    • DA-38660
    • 5-(4-Aminophenoxy)-nicotinic acid methyl ester
    • SCHEMBL2891300
    • 5-(4-Amino-phenoxy)-nicotinic acid methyl ester
    • MDL: MFCD28965406
    • Inchi: 1S/C13H12N2O3/c1-17-13(16)9-6-12(8-15-7-9)18-11-4-2-10(14)3-5-11/h2-8H,14H2,1H3
    • InChI Key: SPPJUUNCUKYHSS-UHFFFAOYSA-N
    • SMILES: O(C1C=NC=C(C(=O)OC)C=1)C1C=CC(=CC=1)N

Computed Properties

  • Exact Mass: 244.08486
  • Monoisotopic Mass: 244.08479225g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 277
  • 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: 1.6
  • Topological Polar Surface Area: 74.4?2

Experimental Properties

  • PSA: 74.44

3-Pyridinecarboxylic acid, 5-(4-aminophenoxy)-, methyl ester Pricemore >>

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5-(4-Aminophenoxy)-nicotinic acid methyl ester, 95%
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$1980.00 2023-09-09
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