Property | Value | Unit | Source |
---|---|---|---|
ΔcH°solid | -422.90 ± 3.30 | kJ/mol | NIST |
EA | 2.06 | eV | NIST |
ΔfG° | 17.66 | kJ/mol | Joback Calculated Property |
ΔfH°gas | 83.90 ± 3.40 | kJ/mol | NIST |
ΔfH°solid | 29.40 ± 3.40 | kJ/mol | NIST |
ΔfusH° | 12.07 | kJ/mol | Joback Calculated Property |
ΔsubH° | 54.50 ± 0.70 | kJ/mol | NIST |
ΔvapH° | 42.26 | kJ/mol | Joback Calculated Property |
IE | [10.30; 10.80] | eV | |
IE | 10.31 ± 0.02 | eV | NIST |
IE | 10.30 ± 0.20 | eV | NIST |
IE | Outlier 10.80 ± 0.30 | eV | NIST |
IE | 10.31 ± 0.02 | eV | NIST |
IE | 10.54 | eV | NIST |
IE | 10.39 | eV | NIST |
IE | 10.40 | eV | NIST |
log10WS | [-3.14; -3.14] | ||
log10WS | -3.14 | Aq. Sol... | |
log10WS | -3.14 | Estimat... | |
logPoct/wat | 3.177 | Crippen Calculated Property | |
McVol | 94.950 | ml/mol | McGowan Calculated Property |
NFPA Health | 3 | KDB | |
NFPA Safety | 1 | KDB | |
Pc | 9630.56 | kPa | Joback Calculated Property |
Inp | [1035.00; 1060.00] | ||
Inp | 1046.00 | NIST | |
Inp | 1060.00 | NIST | |
Inp | 1035.00 | NIST | |
Inp | 1050.00 | NIST | |
Inp | 1054.00 | NIST | |
Inp | 1046.00 | NIST | |
Inp | 1050.00 | NIST | |
I | [1677.81; 1690.77] | ||
I | 1677.81 | NIST | |
I | 1690.77 | NIST | |
Tboil | 483.69 | K | Joback Calculated Property |
Tc | 757.88 | K | Joback Calculated Property |
Tfus | [363.25; 367.60] | K | |
Tfus | 363.25 | K | KDB |
Tfus | 363.25 | K | Aq. Sol... |
Tfus | 367.60 ± 1.00 | K | NIST |
Tfus | 365.00 ± 0.50 | K | NIST |
Tfus | 364.05 ± 0.40 | K | NIST |
Vc | 0.329 | m3/kmol | Joback Calculated Property |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [102.29; 107.03] | J/mol×K | [483.69; 757.88] | |
T(K) Ideal gas heat capacity (J/mol×K) 102 103 104 105 106 107 500 600 700 | ||||
Cp,gas | 102.29 | J/mol×K | 483.69 | Joback Calculated Property |
Cp,gas | 104.31 | J/mol×K | 529.39 | Joback Calculated Property |
Cp,gas | 105.66 | J/mol×K | 575.09 | Joback Calculated Property |
Cp,gas | 106.49 | J/mol×K | 620.78 | Joback Calculated Property |
Cp,gas | 106.91 | J/mol×K | 666.48 | Joback Calculated Property |
Cp,gas | 107.03 | J/mol×K | 712.18 | Joback Calculated Property |
Cp,gas | 106.98 | J/mol×K | 757.88 | Joback Calculated Property |
Cp,liquid | 162.30 | J/mol×K | 373.00 | NIST |
Cp,solid | [128.66; 148.40] | J/mol×K | [298.00; 300.60] | |
Cp,solid | 148.40 | J/mol×K | 298.00 | NIST |
Cp,solid | 145.90 | J/mol×K | 298.15 | NIST |
Cp,solid | 128.66 | J/mol×K | 300.60 | NIST |
η | [0.0005239; 0.0023917] | Pa×s | [342.65; 483.69] | |
T(K) Dynamic viscosity (Pa×s) 5.00e-4 1.00e-3 1.50e-3 2.00e-3 2.50e-3 350 400 450 | ||||
η | 0.0023917 | Pa×s | 342.65 | Joback Calculated Property |
η | 0.0017121 | Pa×s | 366.16 | Joback Calculated Property |
η | 0.0012760 | Pa×s | 389.66 | Joback Calculated Property |
η | 0.0009834 | Pa×s | 413.17 | Joback Calculated Property |
η | 0.0007794 | Pa×s | 436.68 | Joback Calculated Property |
η | 0.0006326 | Pa×s | 460.18 | Joback Calculated Property |
η | 0.0005239 | Pa×s | 483.69 | Joback Calculated Property |
ΔfusH | [3.95; 5.94] | kJ/mol | [320.00; 363.20] | |
ΔfusH | 5.94 | kJ/mol | 320.00 | NIST |
ΔfusH | 3.95 | kJ/mol | 363.20 | NIST |
ΔfusH | 3.95 | kJ/mol | 363.20 | NIST |
ΔvapH | [48.20; 48.30] | kJ/mol | [416.00; 419.00] | |
ΔvapH | 48.20 | kJ/mol | 416.00 | NIST |
ΔvapH | 48.30 | kJ/mol | 419.00 | NIST |
ΔfusS | [10.88; 18.58] | J/mol×K | [320.00; 363.20] | |
ΔfusS | 18.58 | J/mol×K | 320.00 | NIST |
ΔfusS | 10.88 | J/mol×K | 363.20 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.64] | kPa | [344.42; 489.60] | The Yaw... |
Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 1.72437e+01 | |||
Coefficient B | -5.84669e+03 | |||
Coefficient C | 3.90000e-01 | |||
Temperature range, min. | 344.42 | |||
Temperature range, max. | 489.60 | |||
T(K) Vapor pressure (kPa) 0 50 100 150 200 350 400 450 | ||||
Pvap | 1.33 | kPa | 344.42 | Calculated Property |
Pvap | 2.84 | kPa | 360.55 | Calculated Property |
Pvap | 5.69 | kPa | 376.68 | Calculated Property |
Pvap | 10.74 | kPa | 392.81 | Calculated Property |
Pvap | 19.30 | kPa | 408.94 | Calculated Property |
Pvap | 33.18 | kPa | 425.08 | Calculated Property |
Pvap | 54.81 | kPa | 441.21 | Calculated Property |
Pvap | 87.39 | kPa | 457.34 | Calculated Property |
Pvap | 135.00 | kPa | 473.47 | Calculated Property |
Pvap | 202.64 | kPa | 489.60 | Calculated Property |
Pvap | [5.19; 102.61] | kPa | [369.15; 463.15] | KDB Vap... |
Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 2.34543e+02 | |||
Coefficient B | -1.60253e+04 | |||
Coefficient C | -3.25119e+01 | |||
Coefficient D | 1.98033e-05 | |||
Temperature range, min. | 369.15 | |||
Temperature range, max. | 463.15 | |||
T(K) Vapor pressure (kPa) 0 20 40 60 80 100 400 450 | ||||
Pvap | 5.19 | kPa | 369.15 | Calculated Property |
Pvap | 8.07 | kPa | 379.59 | Calculated Property |
Pvap | 12.13 | kPa | 390.04 | Calculated Property |
Pvap | 17.66 | kPa | 400.48 | Calculated Property |
Pvap | 25.01 | kPa | 410.93 | Calculated Property |
Pvap | 34.54 | kPa | 421.37 | Calculated Property |
Pvap | 46.64 | kPa | 431.82 | Calculated Property |
Pvap | 61.72 | kPa | 442.26 | Calculated Property |
Pvap | 80.22 | kPa | 452.71 | Calculated Property |
Pvap | 102.61 | kPa | 463.15 | Calculated Property |
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