Property | Value | Unit | Source |
---|---|---|---|
ΔcH°solid | [-2879.60; -2848.90] | kJ/mol |
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ΔcH°solid | -2868.50 ± 1.00 | kJ/mol | NIST |
ΔcH°solid | -2863.21 ± 0.54 | kJ/mol | NIST |
ΔcH°solid | -2848.90 | kJ/mol | NIST |
ΔcH°solid | -2874.00 | kJ/mol | NIST |
ΔcH°solid | -2879.60 | kJ/mol | NIST |
ΔfG° | -7.02 | kJ/mol | Joback Calculated Property |
ΔfH°gas | [-117.70; -114.70] | kJ/mol |
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ΔfH°gas | -114.70 ± 1.20 | kJ/mol | NIST |
ΔfH°gas | -117.70 ± 2.00 | kJ/mol | NIST |
ΔfH°solid | [-226.70; -207.10] | kJ/mol |
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ΔfH°solid | -207.10 ± 1.10 | kJ/mol | NIST |
ΔfH°solid | -212.40 ± 1.00 | kJ/mol | NIST |
ΔfH°solid | -226.70 | kJ/mol | NIST |
ΔfH°solid | -209.00 | kJ/mol | NIST |
ΔfusH° | 22.48 | kJ/mol | Joback Calculated Property |
ΔsubH° | [92.39; 99.00] | kJ/mol |
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ΔsubH° | 92.39 ± 0.43 | kJ/mol | NIST |
ΔsubH° | 92.40 | kJ/mol | NIST |
ΔsubH° | 99.00 ± 1.00 | kJ/mol | NIST |
ΔvapH° | 60.83 | kJ/mol | Joback Calculated Property |
IE | [7.38; 9.52] | eV |
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IE | 9.10 | eV | NIST |
IE | 7.38 | eV | NIST |
IE | 8.80 ± 0.10 | eV | NIST |
IE | 9.52 | eV | NIST |
IE | 9.38 | eV | NIST |
log10WS | [-0.74; -0.74] |
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|
log10WS | -0.74 | Aq. Sol... | |
log10WS | -0.74 | Estimat... | |
logPoct/wat | 1.300 | Crippen Calculated Property | |
McVol | 94.930 | ml/mol | McGowan Calculated Property |
Pc | 5899.00 | kPa | Joback Calculated Property |
Inp | [260.40; 1588.00] |
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|
Inp | 1530.00 | NIST | |
Inp | 1588.00 | NIST | |
Inp | 1562.00 | NIST | |
Inp | 1544.80 | NIST | |
Inp | 1527.20 | NIST | |
Inp | 1539.00 | NIST | |
Inp | 1546.10 | NIST | |
Inp | 1546.00 | NIST | |
Inp | Outlier 260.40 | NIST | |
Inp | Outlier 262.33 | NIST | |
Inp | 1546.00 | NIST | |
Inp | 1530.00 | NIST | |
Inp | 1546.10 | NIST | |
Tboil | 552.20 | K | NIST |
Tc | 861.12 | K | Joback Calculated Property |
Tfus | [386.41; 386.95] | K |
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Tfus | 386.41 | K | Aq. Sol... |
Tfus | 386.95 | K | KDB |
Vc | 0.311 | m3/kmol | Joback Calculated Property |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [219.41; 261.56] | J/mol×K | [595.82; 861.12] | ![]() |
Cp,gas | 219.41 | J/mol×K | 595.82 | Joback Calculated Property |
Cp,gas | 228.08 | J/mol×K | 640.04 | Joback Calculated Property |
Cp,gas | 235.93 | J/mol×K | 684.25 | Joback Calculated Property |
Cp,gas | 243.08 | J/mol×K | 728.47 | Joback Calculated Property |
Cp,gas | 249.65 | J/mol×K | 772.69 | Joback Calculated Property |
Cp,gas | 255.77 | J/mol×K | 816.90 | Joback Calculated Property |
Cp,gas | 261.56 | J/mol×K | 861.12 | Joback Calculated Property |
Cp,solid | 144.00 | J/mol×K | 283.00 | NIST |
ΔfusH | [11.00; 30.12] | kJ/mol | [368.75; 388.20] | ![]() |
ΔfusH | 19.30 | kJ/mol | 368.75 | NIST |
ΔfusH | 30.12 | kJ/mol | 385.15 | NIST |
ΔfusH | 11.00 | kJ/mol | 386.40 | NIST |
ΔfusH | 18.25 | kJ/mol | 387.00 | NIST |
ΔfusH | 24.27 | kJ/mol | 387.00 | NIST |
ΔfusH | 18.25 | kJ/mol | 388.20 | NIST |
ΔfusH | 18.25 | kJ/mol | 388.20 | NIST |
ΔsubH | [91.00; 91.20] | kJ/mol | [343.00; 345.00] | ![]() |
ΔsubH | 91.00 ± 2.00 | kJ/mol | 343.00 | NIST |
ΔsubH | 91.20 ± 1.70 | kJ/mol | 345.00 | NIST |
ΔfusS | [47.17; 78.20] | J/mol×K | [368.75; 387.00] | ![]() |
ΔfusS | 52.30 | J/mol×K | 368.75 | NIST |
ΔfusS | 78.20 | J/mol×K | 385.15 | NIST |
ΔfusS | 47.17 | J/mol×K | 387.00 | NIST |
ΔfusS | 62.70 | J/mol×K | 387.00 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.65] | kPa | [319.32; 638.61] |
The Yaw...
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Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 9.12213e+00 | |||
Coefficient B | -2.13960e+03 | |||
Coefficient C | -7.71340e+01 | |||
Temperature range, min. | 319.32 | |||
Temperature range, max. | 638.61 | |||
Pvap | 1.33 | kPa | 319.32 | Calculated Property |
Pvap | 4.12 | kPa | 354.80 | Calculated Property |
Pvap | 9.87 | kPa | 390.27 | Calculated Property |
Pvap | 19.78 | kPa | 425.75 | Calculated Property |
Pvap | 34.87 | kPa | 461.23 | Calculated Property |
Pvap | 55.85 | kPa | 496.70 | Calculated Property |
Pvap | 83.11 | kPa | 532.18 | Calculated Property |
Pvap | 116.78 | kPa | 567.66 | Calculated Property |
Pvap | 156.72 | kPa | 603.13 | Calculated Property |
Pvap | 202.65 | kPa | 638.61 | Calculated Property |
Pvap | [0.25; 2.53] | kPa | [415.15; 459.15] |
KDB Vap...
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Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 7.50049e+01 | |||
Coefficient B | -1.28318e+04 | |||
Coefficient C | -7.64739e+00 | |||
Coefficient D | 3.52466e-06 | |||
Temperature range, min. | 415.15 | |||
Temperature range, max. | 459.15 | |||
Pvap | 0.25 | kPa | 415.15 | Calculated Property |
Pvap | 0.33 | kPa | 420.04 | Calculated Property |
Pvap | 0.43 | kPa | 424.93 | Calculated Property |
Pvap | 0.57 | kPa | 429.82 | Calculated Property |
Pvap | 0.74 | kPa | 434.71 | Calculated Property |
Pvap | 0.96 | kPa | 439.59 | Calculated Property |
Pvap | 1.23 | kPa | 444.48 | Calculated Property |
Pvap | 1.57 | kPa | 449.37 | Calculated Property |
Pvap | 2.00 | kPa | 454.26 | Calculated Property |
Pvap | 2.53 | kPa | 459.15 | Calculated Property |
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