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Properties of 1-Acetyl-5-bromo-4-chloro-1H-indol-3-yl acetate

Thermophysical properties for 1-Acetyl-5-bromo-4-chloro-1H-indol-3-yl acetate (CAS: 3030-06-6). Use the selector below to view properties in different unit systems.

Calculation Conditions

The following state-dependent properties were calculated at these standard conditions.

Temperature

25 °C

Pressure

1.01325 bar

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Identification

  • Atoms
    Br: 1, C: 12, Cl: 1, H: 9, N: 1, O: 3
  • CAS
    3030-06-6
  • Formula
    C12H9BrClNO3
  • ID
    3030-06-6
  • InChI
    C12H9BrClNO3/c1-6(16)15-5-10(18-7(2)17)11-9(15)4-3-8(13)12(11)14/h3-5H,1-2H3
  • InChI Key
    DSHQTSIXXYZXGR-UHFFFAOYSA-N
  • IUPAC Name
    (1-acetyl-5-bromo-4-chloroindol-3-yl) acetate
  • Molecular Weight (kg)
    330.562
  • Phase
    s
  • PubChem ID
    7.6416e+4
  • SMILES
    CC(=O)Oc1cn(C(C)=O)c2ccc(Br)c(Cl)c12
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    29.9587
  • Critical temperature (°C)
    716.263
  • Critical volume (m³/kmol)
    0.7125
  • Dipole moment
  • Melting temperature (°C)
    161.5
  • Normal boiling temperature (°C)
    482.03

State-dependent Properties

  • API gravity
    -39.7861
  • Compressibility factor
    0.00806119
  • Density (kg/m³)
    1676.1
  • Dynamic viscosity (cP)
    0
  • Enthalpy of vaporization (mass) (kJ)
    0
  • Enthalpy of vaporization (molar) (kJ/kmol)
  • Gibbs free energy (kJ/kmol)
    0
  • Joule–Thomson coefficient
  • Kinematic viscosity
  • Molar enthalpy (kJ/kmol)
    0
  • Molar entropy (kJ/(kmol·K))
    0
  • Molar heat capacity (kJ/(kmol·K))
    255.14
  • Molar volume (m³/kmol)
    0.19722
  • Parachor
    1.1222e-4
  • Poynting correction factor
    1.00884
  • Prandtl number
  • Saturation pressure (bar)
    3.0358e-10
  • Saturation temperature (°C)
    482.03
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.67775
  • Specific heat capacity (kJ/kg·K)
    0.771838
  • Surface tension
    0.0710941
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00891555
  • Upper flammability limit
    0.0567353

Environmental Properties

  • Global warming potential
  • Ozone depletion potential