Cas no 1033955-78-0 (Methyl 4-iodopyridine-3-carboxylate)

Methyl 4-iodopyridine-3-carboxylate structure
1033955-78-0 structure
Product Name:Methyl 4-iodopyridine-3-carboxylate
CAS No:1033955-78-0
MF:C7H6INO2
MW:263.032514095306
CID:1141271
PubChem ID:23436932
Update Time:2025-04-20

Methyl 4-iodopyridine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-iodopyridine-3-carboxylate
    • methyl 4-iodonicotinate
    • DTXSID50634096
    • SCHEMBL5700411
    • 1033955-78-0
    • 4-Iodopyridine-3-carboxylic acid methyl ester
    • Inchi: 1S/C7H6INO2/c1-11-7(10)5-4-9-3-2-6(5)8/h2-4H,1H3
    • InChI Key: XYUMHCBHMGKHBG-UHFFFAOYSA-N
    • SMILES: IC1C=CN=CC=1C(=O)OC

Computed Properties

  • Exact Mass: 262.94433g/mol
  • Monoisotopic Mass: 262.94433g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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
  • Molecular Weight: 263.03g/mol
  • XLogP3: 1.4
  • Topological Polar Surface Area: 39.2?2
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