Cas no 61214-23-1 (1H-Isoindol-1-one, 2,3-dihydro-2-propyl-)

1H-Isoindol-1-one, 2,3-dihydro-2-propyl- structure
61214-23-1 structure
Product Name:1H-Isoindol-1-one, 2,3-dihydro-2-propyl-
CAS No:61214-23-1
MF:C11H13NO
MW:175.227022886276
CID:1626123
Update Time:2024-08-30

1H-Isoindol-1-one, 2,3-dihydro-2-propyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Isoindol-1-one, 2,3-dihydro-2-propyl-
    • Inchi: 1S/C11H13NO/c1-2-7-12-8-9-5-3-4-6-10(9)11(12)13/h3-6H,2,7-8H2,1H3
    • InChI Key: CSTLMZMSCCVIIW-UHFFFAOYSA-N
    • SMILES: C1(=O)C2=C(C=CC=C2)CN1CCC

Computed Properties

  • Exact Mass: 175.09979

Experimental Properties

  • Density: 1.094±0.06 g/cm3(Predicted)
  • Boiling Point: 313.8±31.0 °C(Predicted)
  • PSA: 20.31
  • pka: -1.17±0.20(Predicted)

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