Cas no 21173-88-6 (1,3-Cyclotridecanedione)

1,3-Cyclotridecanedione structure
1,3-Cyclotridecanedione structure
Product Name:1,3-Cyclotridecanedione
CAS No:21173-88-6
MF:C13H22O2
MW:210.312584400177
CID:1403294
Update Time:2024-08-16

1,3-Cyclotridecanedione Chemical and Physical Properties

Names and Identifiers

    • 1,3-Cyclotridecanedione
    • Inchi: 1S/C13H22O2/c14-12-9-7-5-3-1-2-4-6-8-10-13(15)11-12/h1-11H2
    • InChI Key: CYVWMHDEDARXLP-UHFFFAOYSA-N
    • SMILES: C1(=O)CCCCCCCCCCC(=O)C1

Computed Properties

  • Exact Mass: 210.16206

Experimental Properties

  • Density: 0.940±0.06 g/cm3(Predicted)
  • Boiling Point: 102-104 °C(Press: 0.998 Torr)
  • PSA: 34.14
  • pka: 9.60±0.20(Predicted)
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