Cas no 259807-47-1 (2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid)

2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid structure
259807-47-1 structure
Product Name:2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid
CAS No:259807-47-1
MF:C10H7N3O2
MW:201.181481599808
CID:247218
PubChem ID:22710213
Update Time:2025-04-19

2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid
    • 2-pyrid-4-ylpyrimidine-5-carboxylic acid
    • 5-Pyrimidinecarboxylicacid, 2-(4-pyridinyl)-
    • AG-E-80707
    • CC66601
    • CTK1A0533
    • KB-84228
    • MolPort-000-144-065
    • SBB092748
    • SureCN4636874
    • 2-(4-Pyridinyl)-5-pyrimidinecarboxylic acid
    • GTKJGOOMSODGOU-UHFFFAOYSA-N
    • EN300-768298
    • DTXSID80627678
    • FT-0718651
    • PS-8199
    • CS-0205651
    • 2-pyridin-4-ylpyrimidine-5-carboxylic acid
    • AKOS000284219
    • 5-Pyrimidinecarboxylic acid, 2-(4-pyridinyl)-
    • 2-(Pyridin-4-yl)pyrimidine-5-carboxylicacid
    • 5-Pyrimidinecarboxylic acid, 2-(4-pyridinyl)- (9CI)
    • 259807-47-1
    • MFCD09863218
    • 2-pyridin-4-yl-pyrimidine-5-carboxylic acid
    • SCHEMBL4636874
    • DB-067510
    • MDL: MFCD09863218
    • Inchi: 1S/C10H7N3O2/c14-10(15)8-5-12-9(13-6-8)7-1-3-11-4-2-7/h1-6H,(H,14,15)
    • InChI Key: GTKJGOOMSODGOU-UHFFFAOYSA-N
    • SMILES: OC(C1C=NC(C2C=CN=CC=2)=NC=1)=O

Computed Properties

  • Exact Mass: 201.05391
  • Monoisotopic Mass: 201.053826475g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 221
  • 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: 0.3
  • Topological Polar Surface Area: 76?2

Experimental Properties

  • Density: 1.369
  • Melting Point: 403.5-404.5°C
  • Boiling Point: 334.2°Cat760mmHg
  • Flash Point: 155.9°C
  • Refractive Index: 1.627
  • PSA: 75.97
  • LogP: 1.23680
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

2-(Pyridin-4-yl)pyrimidine-5-carboxylic acid Security Information

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