Cas no 18380-36-4 (2H-Azepin-2-one, hexahydro-1-[(trichloromethyl)thio]-)

2H-Azepin-2-one, hexahydro-1-[(trichloromethyl)thio]- structure
18380-36-4 structure
Product Name:2H-Azepin-2-one, hexahydro-1-[(trichloromethyl)thio]-
CAS No:18380-36-4
MF:C7H10Cl3NOS
MW:262.584397792816
CID:1377595
Update Time:2024-08-14

2H-Azepin-2-one, hexahydro-1-[(trichloromethyl)thio]- Chemical and Physical Properties

Names and Identifiers

    • 2H-Azepin-2-one, hexahydro-1-[(trichloromethyl)thio]-
    • Inchi: 1S/C7H10Cl3NOS/c8-7(9,10)13-11-5-3-1-2-4-6(11)12/h1-5H2
    • InChI Key: HCPYBXBHEJXTRA-UHFFFAOYSA-N
    • SMILES: N1(SC(Cl)(Cl)Cl)CCCCCC1=O

Experimental Properties

  • Density: 1.46±0.1 g/cm3(Predicted)
  • Melting Point: 91-92 °C(Solv: ligroine (8032-32-4))
  • Boiling Point: 252.8±50.0 °C(Predicted)
  • pka: -1.66±0.20(Predicted)

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