Property | Value | Unit | Source |
---|---|---|---|
ω | 0.3730 | KDB | |
PAff | 690.40 | kJ/mol | NIST |
BasG | 662.70 | kJ/mol | NIST |
ΔcH°liquid | -2557.00 ± 1.40 | kJ/mol | NIST |
EA | [0.43; 0.73] | eV | |
EA | 0.43 ± 0.09 | eV | NIST |
EA | 0.73 ± 0.08 | eV | NIST |
ΔfG° | -900.52 | kJ/mol | Joback Calculated Property |
ΔfH°gas | -806.00 ± 1.40 | kJ/mol | NIST |
ΔfH°liquid | -842.20 ± 1.40 | kJ/mol | NIST |
ΔfusH° | 19.18 | kJ/mol | Joback Calculated Property |
ΔvapH° | [36.20; 36.39] | kJ/mol | |
ΔvapH° | 36.36 | kJ/mol | NIST |
ΔvapH° | 36.20 | kJ/mol | NIST |
ΔvapH° | 36.20 ± 0.20 | kJ/mol | NIST |
ΔvapH° | 36.39 | kJ/mol | NIST |
IE | [9.63; 9.90] | eV | |
IE | 9.63 | eV | NIST |
IE | 9.73 | eV | NIST |
IE | 9.63 ± 0.00 | eV | NIST |
IE | 9.82 | eV | NIST |
IE | 9.84 | eV | NIST |
IE | 9.90 | eV | NIST |
IE | 9.64 | eV | NIST |
log10WS | -3.13 | Crippen Calculated Property | |
logPoct/wat | 2.382 | Crippen Calculated Property | |
McVol | 80.490 | ml/mol | McGowan Calculated Property |
Pc | [3470.00; 3531.00] | kPa | |
Pc | 3531.00 | kPa | KDB |
Pc | 3470.00 | kPa | NIST |
Pc | 3531.00 ± 5.00 | kPa | NIST |
Pc | 3516.00 ± 10.00 | kPa | NIST |
ρc | 517.64 ± 0.50 | kg/m3 | NIST |
Inp | [589.00; 594.00] | ||
Inp | 589.00 | NIST | |
Inp | 594.00 | NIST | |
Inp | 589.00 | NIST | |
S°liquid | [275.90; 279.49] | J/mol×K | |
S°liquid | 279.49 | J/mol×K | NIST |
S°liquid | 275.90 | J/mol×K | NIST |
Tboil | [357.50; 358.90] | K | |
Tboil | 358.89 | K | KDB |
Tboil | 358.00 | K | NIST |
Tboil | 358.20 | K | NIST |
Tboil | 357.50 ± 0.50 | K | NIST |
Tboil | 358.90 | K | NIST |
Tboil | 358.89 ± 0.00 | K | NIST |
Tboil | 358.89 ± 0.01 | K | NIST |
Tboil | 357.75 ± 0.05 | K | NIST |
Tc | [530.80; 532.00] | K | |
Tc | 530.97 | K | KDB |
Tc | 531.04 | K | Density... |
Tc | 532.00 | K | NIST |
Tc | 530.80 | K | NIST |
Tc | 530.96 ± 0.05 | K | NIST |
Tc | 530.97 ± 0.03 | K | NIST |
Tc | 531.95 ± 0.05 | K | NIST |
Tfus | 225.80 | K | KDB |
Ttriple | [225.67; 225.83] | K | |
Ttriple | 225.67 ± 0.02 | K | NIST |
Ttriple | 225.83 ± 0.02 | K | NIST |
Vc | 0.324 | m3/kmol | KDB |
Zc | 0.2591410 | KDB |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [150.60; 181.83] | J/mol×K | [379.63; 545.30] | |
T(K) Ideal gas heat capacity (J/mol×K) 150 155 160 165 170 175 180 400 450 500 | ||||
Cp,gas | 150.60 | J/mol×K | 379.63 | Joback Calculated Property |
Cp,gas | 156.29 | J/mol×K | 407.24 | Joback Calculated Property |
Cp,gas | 161.79 | J/mol×K | 434.85 | Joback Calculated Property |
Cp,gas | 167.09 | J/mol×K | 462.46 | Joback Calculated Property |
Cp,gas | 172.20 | J/mol×K | 490.07 | Joback Calculated Property |
Cp,gas | 177.11 | J/mol×K | 517.69 | Joback Calculated Property |
Cp,gas | 181.83 | J/mol×K | 545.30 | Joback Calculated Property |
Cp,liquid | [204.70; 210.79] | J/mol×K | [298.15; 298.15] | |
Cp,liquid | 210.79 | J/mol×K | 298.15 | NIST |
Cp,liquid | 204.70 | J/mol×K | 298.15 | NIST |
ΔfusH | [10.85; 10.88] | kJ/mol | [225.67; 225.83] | |
ΔfusH | 10.88 | kJ/mol | 225.67 | NIST |
ΔfusH | 10.88 | kJ/mol | 225.70 | NIST |
ΔfusH | 10.88 | kJ/mol | 225.70 | NIST |
ΔfusH | 10.85 | kJ/mol | 225.83 | NIST |
ΔvapH | [32.00; 35.70] | kJ/mol | [190.00; 502.00] | |
T(K) Enthalpy of vaporization at a given temperature (kJ/mol) 32 33 34 35 36 200 300 400 500 | ||||
ΔvapH | 34.78 ± 0.01 | kJ/mol | 190.00 | NIST |
ΔvapH | 35.70 | kJ/mol | 328.00 | NIST |
ΔvapH | 34.80 | kJ/mol | 345.00 | NIST |
ΔvapH | 32.15 | kJ/mol | 358.90 | NIST |
ΔvapH | 33.50 | kJ/mol | 377.50 | NIST |
ΔvapH | 32.60 | kJ/mol | 436.00 | NIST |
ΔvapH | 32.00 | kJ/mol | 451.50 | NIST |
ΔvapH | 32.20 | kJ/mol | 502.00 | NIST |
ρl | [1453.00; 1511.00] | kg/m3 | [296.90; 327.60] | |
ρl | 1511.00 | kg/m3 | 296.90 | Liquid-... |
ρl | 1453.00 | kg/m3 | 327.60 | Liquid-... |
ΔfusS | [48.06; 48.22] | J/mol×K | [225.67; 225.83] | |
ΔfusS | 48.22 | J/mol×K | 225.67 | NIST |
ΔfusS | 48.06 | J/mol×K | 225.83 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.66] | kPa | [264.89; 381.18] | The Yaw... |
Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 1.43600e+01 | |||
Coefficient B | -2.94750e+03 | |||
Coefficient C | -5.54340e+01 | |||
Temperature range, min. | 264.89 | |||
Temperature range, max. | 381.18 | |||
T(K) Vapor pressure (kPa) 0 50 100 150 200 300 350 | ||||
Pvap | 1.33 | kPa | 264.89 | Calculated Property |
Pvap | 3.02 | kPa | 277.81 | Calculated Property |
Pvap | 6.25 | kPa | 290.73 | Calculated Property |
Pvap | 12.01 | kPa | 303.65 | Calculated Property |
Pvap | 21.61 | kPa | 316.57 | Calculated Property |
Pvap | 36.79 | kPa | 329.50 | Calculated Property |
Pvap | 59.70 | kPa | 342.42 | Calculated Property |
Pvap | 92.93 | kPa | 355.34 | Calculated Property |
Pvap | 139.46 | kPa | 368.26 | Calculated Property |
Pvap | 202.66 | kPa | 381.18 | Calculated Property |
Pvap | [26.71; 3318.95] | kPa | [322.00; 526.82] | KDB Vap... |
Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 8.99831e+01 | |||
Coefficient B | -7.29499e+03 | |||
Coefficient C | -1.12510e+01 | |||
Coefficient D | 8.93524e-06 | |||
Temperature range, min. | 322.00 | |||
Temperature range, max. | 526.82 | |||
T(K) Vapor pressure (kPa) 0 500 1000 1500 2000 2500 3000 3500 350 400 450 500 | ||||
Pvap | 26.71 | kPa | 322.00 | Calculated Property |
Pvap | 63.28 | kPa | 344.76 | Calculated Property |
Pvap | 132.10 | kPa | 367.52 | Calculated Property |
Pvap | 249.42 | kPa | 390.27 | Calculated Property |
Pvap | 434.73 | kPa | 413.03 | Calculated Property |
Pvap | 710.69 | kPa | 435.79 | Calculated Property |
Pvap | 1103.43 | kPa | 458.55 | Calculated Property |
Pvap | 1643.44 | kPa | 481.30 | Calculated Property |
Pvap | 2367.12 | kPa | 504.06 | Calculated Property |
Pvap | 3318.95 | kPa | 526.82 | Calculated Property |
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