Cas no 64224-64-2 (4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester)

4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester structure
64224-64-2 structure
Product Name:4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester
CAS No:64224-64-2
MF:C7H7ClN2O2
MW:186.595680475235
CID:499995
PubChem ID:21329182
Update Time:2025-04-19

4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester
    • ethyl 5-chloropyrimidine-4-carboxylate
    • 5-chloro-4-pyrimidinecarboxylic acid ethyl ester
    • ethyl 5-chloranylpyrimidine-4-carboxylate
    • ethyl5-chloropyrimidine-4-carboxylate
    • 5-chloro-4-ethoxycarbonylpyrimidine
    • DEYGEGYALNIWBC-UHFFFAOYSA-N
    • DTXSID60612502
    • AB63706
    • EN300-7813165
    • SCHEMBL11528806
    • AKOS006308219
    • 64224-64-2
    • A834679
    • Z1198316378
    • Inchi: 1S/C7H7ClN2O2/c1-2-12-7(11)6-5(8)3-9-4-10-6/h3-4H,2H2,1H3
    • InChI Key: DEYGEGYALNIWBC-UHFFFAOYSA-N
    • SMILES: ClC1=CN=CN=C1C(=O)OCC

Computed Properties

  • Exact Mass: 186.02000
  • Monoisotopic Mass: 186.02
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 166
  • 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
  • Topological Polar Surface Area: 52.1A^2
  • XLogP3: 1.4

Experimental Properties

  • PSA: 52.08000
  • LogP: 1.30670

4-Pyrimidinecarboxylicacid, 5-chloro-, ethyl ester Pricemore >>

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