Cas no 127958-06-9 (4-Ethyl-2-methylpyrimidine-5-carboxylic acid)

4-Ethyl-2-methylpyrimidine-5-carboxylic acid structure
127958-06-9 structure
Product Name:4-Ethyl-2-methylpyrimidine-5-carboxylic acid
CAS No:127958-06-9
MF:C8H10N2O2
MW:166.177201747894
MDL:MFCD08689469
CID:63909
PubChem ID:14639228
Update Time:2025-09-21

4-Ethyl-2-methylpyrimidine-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Ethyl-2-methylpyrimidine-5-carboxylic acid
    • 5-Pyrimidinecarboxylicacid, 4-ethyl-2-methyl-
    • ACMC-20mso2
    • AG-D-58040
    • AGN-PC-00224V
    • CTK0G9321
    • MolPort-004-804-166
    • 5-Pyrimidinecarboxylic acid, 4-ethyl-2-methyl- (9CI)
    • DTXSID40562455
    • SB56301
    • FT-0754257
    • 5-Pyrimidinecarboxylic acid, 4-ethyl-2-methyl-
    • 4-Ethyl-2-methyl-pyrimidine-5-carboxylicacid
    • EN300-80353
    • AKOS005264717
    • 4-ETHYL-2-METHYLPYRIMIDINE-5-CARBOXYLICACID
    • CS-0261876
    • Z851011838
    • 4-Ethyl-2-methyl-5-pyrimidinecarboxylic acid
    • 5-pyrimidinecarboxylic acid,4-ethyl-2-methyl-
    • SCHEMBL15718403
    • 127958-06-9
    • DB-062622
    • G57380
    • MDL: MFCD08689469
    • Inchi: 1S/C8H10N2O2/c1-3-7-6(8(11)12)4-9-5(2)10-7/h4H,3H2,1-2H3,(H,11,12)
    • InChI Key: XQRXSIZGVKLXKW-UHFFFAOYSA-N
    • SMILES: OC(C1=CN=C(C)N=C1CC)=O

Computed Properties

  • Exact Mass: 166.0743
  • Monoisotopic Mass: 166.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 172
  • 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
  • Surface Charge: 0
  • Tautomer Count: 5
  • XLogP3: 1
  • Topological Polar Surface Area: 63.1?2

Experimental Properties

  • PSA: 63.08

4-Ethyl-2-methylpyrimidine-5-carboxylic acid Security Information

4-Ethyl-2-methylpyrimidine-5-carboxylic acid Pricemore >>

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