Cas no 954233-05-7 (2-Cyclopropyl-4-methylpyrimidine-5-carboxylic acid)

2-Cyclopropyl-4-methylpyrimidine-5-carboxylic acid structure
954233-05-7 structure
Product Name:2-Cyclopropyl-4-methylpyrimidine-5-carboxylic acid
CAS No:954233-05-7
MF:C9H10N2O2
MW:178.187901973724
MDL:MFCD09750211
CID:1073403
PubChem ID:22308493
Update Time:2025-04-20

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

Names and Identifiers

    • 2-Cyclopropyl-4-methylpyrimidine-5-carboxylic acid
    • 2-cyclopropyl-4-methyl-5-pyrimidinecarboxylic acid(SALTDATA: FREE)
    • 2-Cyclopropyl-4-methyl-pyrimidine-5-carboxylic acid
    • 2-cyclopropyl-4-methylpyrimidine-5-carboxylicacid
    • FT-0681767
    • BSLXWOKIRNVYGN-UHFFFAOYSA-N
    • DTXSID20624525
    • MFCD09750211
    • AKOS000111365
    • Z851011368
    • NCGC00327786-01
    • 954233-05-7
    • 2-cyclopropyl-4-methyl-5-pyrimidinecarboxylic acid
    • SCHEMBL2374960
    • FS-6330
    • CS-0257924
    • BB 0238501
    • SB55652
    • AB01323005-02
    • 2-Cyclopropyl-4-methyl-pyrimidine-5-carboxy lic acid
    • EN300-685411
    • G32797
    • STK519352
    • MDL: MFCD09750211
    • Inchi: 1S/C9H10N2O2/c1-5-7(9(12)13)4-10-8(11-5)6-2-3-6/h4,6H,2-3H2,1H3,(H,12,13)
    • InChI Key: BSLXWOKIRNVYGN-UHFFFAOYSA-N
    • SMILES: OC(C1C=NC(C2CC2)=NC=1C)=O

Computed Properties

  • Exact Mass: 178.074227566g/mol
  • Monoisotopic Mass: 178.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 216
  • 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: 0.7
  • Topological Polar Surface Area: 63.1?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 351.9±22.0 °C at 760 mmHg
  • Flash Point: 166.6±22.3 °C
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

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

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