Property | Value | Unit | Source |
---|---|---|---|
PAff | 876.40 | kJ/mol | NIST |
BasG | 846.60 | kJ/mol | NIST |
ΔcH°liquid | [-4782.77; -4781.70] | kJ/mol |
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ΔcH°liquid | -4782.77 ± 0.84 | kJ/mol | NIST |
ΔcH°liquid | -4781.70 ± 2.00 | kJ/mol | NIST |
ΔfG° | 27.88 | kJ/mol | Joback Calculated Property |
ΔfH°gas | [-143.00; -141.50] | kJ/mol |
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ΔfH°gas | -142.00 ± 1.30 | kJ/mol | NIST |
ΔfH°gas | -141.50 | kJ/mol | NIST |
ΔfH°gas | -143.00 ± 3.00 | kJ/mol | NIST |
ΔfH°liquid | [-182.00; -181.10] | kJ/mol |
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ΔfH°liquid | -181.10 ± 0.96 | kJ/mol | NIST |
ΔfH°liquid | -182.00 ± 2.00 | kJ/mol | NIST |
ΔfusH° | 8.38 | kJ/mol | Joback Calculated Property |
ΔvapH° | [39.00; 39.64] | kJ/mol |
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ΔvapH° | 39.64 | kJ/mol | NIST |
ΔvapH° | 39.60 ± 0.20 | kJ/mol | NIST |
ΔvapH° | 39.10 | kJ/mol | NIST |
ΔvapH° | 39.60 ± 0.10 | kJ/mol | NIST |
ΔvapH° | 39.60 ± 0.80 | kJ/mol | NIST |
ΔvapH° | 39.00 ± 1.00 | kJ/mol | NIST |
ΔvapH° | 39.00 | kJ/mol | NIST |
IE | [8.00; 8.38] | eV |
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IE | 8.20 ± 0.20 | eV | NIST |
IE | 8.00 | eV | NIST |
IE | 8.25 ± 0.01 | eV | NIST |
IE | 8.38 ± 0.05 | eV | NIST |
IE | 8.26 | eV | NIST |
IE | 8.26 | eV | NIST |
log10WS | [-2.24; -2.24] |
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|
log10WS | -2.24 | Aq. Sol... | |
log10WS | -2.24 | Estimat... | |
logPoct/wat | 2.536 | Crippen Calculated Property | |
McVol | 111.750 | ml/mol | McGowan Calculated Property |
Pc | 3224.64 | kPa | Joback Calculated Property |
Inp | [778.00; 788.00] |
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|
Inp | 788.00 | NIST | |
Inp | 787.00 | NIST | |
Inp | 788.00 | NIST | |
Inp | 788.00 | NIST | |
Inp | Outlier 778.00 | NIST | |
Inp | 784.00 | NIST | |
Inp | 788.00 | NIST | |
S°liquid | 313.05 | J/mol×K | NIST |
Tboil | [393.00; 412.50] | K |
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Tboil | 393.20 | K | NIST |
Tboil | 393.20 | K | NIST |
Tboil | 393.00 ± 2.00 | K | NIST |
Tboil | 393.00 ± 0.30 | K | NIST |
Tboil | Outlier 412.50 ± 0.60 | K | NIST |
Tboil | 393.65 ± 0.50 | K | NIST |
Tboil | 393.00 ± 4.00 | K | NIST |
Tboil | 393.00 ± 2.00 | K | NIST |
Tc | 602.65 | K | Joback Calculated Property |
Tfus | [181.10; 195.07] | K |
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Tfus | 181.10 | K | Aq. Sol... |
Tfus | 195.07 ± 0.10 | K | NIST |
Ttriple | 195.07 ± 0.01 | K | NIST |
Vc | 0.413 | m3/kmol | Joback Calculated Property |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [206.45; 272.54] | J/mol×K | [404.58; 602.65] | ![]() |
T(K) Ideal gas heat capacity (J/mol×K) 200 210 220 230 240 250 260 270 400 500 600 | ||||
Cp,gas | 206.45 | J/mol×K | 404.58 | Joback Calculated Property |
Cp,gas | 218.68 | J/mol×K | 437.59 | Joback Calculated Property |
Cp,gas | 230.42 | J/mol×K | 470.60 | Joback Calculated Property |
Cp,gas | 241.66 | J/mol×K | 503.61 | Joback Calculated Property |
Cp,gas | 252.43 | J/mol×K | 536.62 | Joback Calculated Property |
Cp,gas | 262.72 | J/mol×K | 569.63 | Joback Calculated Property |
Cp,gas | 272.54 | J/mol×K | 602.65 | Joback Calculated Property |
Cp,liquid | 232.00 | J/mol×K | 298.15 | NIST |
ΔfusH | [10.41; 10.42] | kJ/mol | [195.07; 195.10] | ![]() |
ΔfusH | 10.41 | kJ/mol | 195.07 | NIST |
ΔfusH | 10.42 | kJ/mol | 195.10 | NIST |
ΔfusH | 10.42 | kJ/mol | 195.10 | NIST |
ΔvapH | [33.80; 39.40] | kJ/mol | [315.50; 393.20] | ![]() |
T(K) Enthalpy of vaporization at a given temperature (kJ/mol) 34 35 36 37 38 39 320 340 360 380 | ||||
ΔvapH | 38.50 | kJ/mol | 315.50 | NIST |
ΔvapH | 39.40 | kJ/mol | 356.50 | NIST |
ΔvapH | 37.40 | kJ/mol | 365.00 | NIST |
ΔvapH | 37.70 | kJ/mol | 378.50 | NIST |
ΔvapH | 33.80 | kJ/mol | 393.20 | NIST |
ΔfusS | 53.39 | J/mol×K | 195.07 | NIST |
Property | Value | Unit | Pressure (kPa) | Source |
---|---|---|---|---|
Tboilr | 393.20 | K | 102.00 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.67] | kPa | [290.55; 422.13] |
The Yaw...
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Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 1.44790e+01 | |||
Coefficient B | -3.40729e+03 | |||
Coefficient C | -5.04570e+01 | |||
Temperature range, min. | 290.55 | |||
Temperature range, max. | 422.13 | |||
T(K) Vapor pressure (kPa) 0 50 100 150 200 300 350 400 | ||||
Pvap | 1.33 | kPa | 290.55 | Calculated Property |
Pvap | 3.01 | kPa | 305.17 | Calculated Property |
Pvap | 6.22 | kPa | 319.79 | Calculated Property |
Pvap | 11.94 | kPa | 334.41 | Calculated Property |
Pvap | 21.48 | kPa | 349.03 | Calculated Property |
Pvap | 36.59 | kPa | 363.65 | Calculated Property |
Pvap | 59.44 | kPa | 378.27 | Calculated Property |
Pvap | 92.64 | kPa | 392.89 | Calculated Property |
Pvap | 139.24 | kPa | 407.51 | Calculated Property |
Pvap | 202.67 | kPa | 422.13 | Calculated Property |
Pvap | [1.30; 3242.69] | kPa | [286.15; 585.71] |
KDB Vap...
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Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 8.88044e+01 | |||
Coefficient B | -7.67655e+03 | |||
Coefficient C | -1.10212e+01 | |||
Coefficient D | 7.64446e-06 | |||
Temperature range, min. | 286.15 | |||
Temperature range, max. | 585.71 | |||
T(K) Vapor pressure (kPa) 0 500 1000 1500 2000 2500 3000 3500 300 400 500 | ||||
Pvap | 1.30 | kPa | 286.15 | Calculated Property |
Pvap | 7.38 | kPa | 319.43 | Calculated Property |
Pvap | 28.35 | kPa | 352.72 | Calculated Property |
Pvap | 82.72 | kPa | 386.00 | Calculated Property |
Pvap | 197.84 | kPa | 419.29 | Calculated Property |
Pvap | 409.08 | kPa | 452.57 | Calculated Property |
Pvap | 759.43 | kPa | 485.86 | Calculated Property |
Pvap | 1301.14 | kPa | 519.14 | Calculated Property |
Pvap | 2100.01 | kPa | 552.43 | Calculated Property |
Pvap | 3242.69 | kPa | 585.71 | Calculated Property |
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