| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.2060 | KDB | |
| PAff | 766.30 | kJ/mol | NIST |
| AP | 263.150 | K | KDB |
| BasG | 733.80 | kJ/mol | NIST |
| ΔcH°liquid | -3115.20 ± 0.59 | kJ/mol | NIST |
| μ | 0.90 | debye | KDB |
| ΔfG° | 190.90 | kJ/mol | KDB |
| Δc,grossH | 3115.20 | kJ/mol | KDB |
| Δc,netH | 2939.134 | kJ/mol | KDB |
| ΔfH°gas | [32.60; 36.00] | kJ/mol |
|
| ΔfH°gas | 32.95 | kJ/mol | KDB |
| ΔfH°gas | 36.00 | kJ/mol | NIST |
| ΔfH°gas | 34.00 | kJ/mol | NIST |
| ΔfH°gas | 32.60 | kJ/mol | NIST |
| ΔfH°gas | 33.20 | kJ/mol | NIST |
| ΔfH°liquid | [4.27; 4.85] | kJ/mol |
|
| ΔfH°liquid | 4.27 ± 0.63 | kJ/mol | NIST |
| ΔfH°liquid | 4.85 ± 0.67 | kJ/mol | NIST |
| ΔfusH° | 2.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 28.37 | kJ/mol | NIST |
| IE | [9.00; 9.20] | eV |
|
| IE | 9.01 ± 0.01 | eV | NIST |
| IE | 9.18 | eV | NIST |
| IE | 9.10 | eV | NIST |
| IE | 9.01 ± 0.02 | eV | NIST |
| IE | 9.00 | eV | NIST |
| IE | 9.02 ± 0.01 | eV | NIST |
| IE | 9.00 | eV | NIST |
| IE | 9.01 ± 0.01 | eV | NIST |
| IE | 9.02 ± 0.01 | eV | NIST |
| IE | 9.01 | eV | NIST |
| IE | 9.00 | eV | NIST |
| IE | 9.01 ± 0.01 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.01 ± 0.03 | eV | NIST |
| IE | 9.17 | eV | NIST |
| IE | 9.12 | eV | NIST |
| IE | 9.18 | eV | NIST |
| IE | 9.20 | eV | NIST |
| log10WS | [-2.10; -2.10] |
|
|
| log10WS | -2.10 | Aq. Solubility Prediction | |
| log10WS | -2.10 | Estimated Solubility | |
| logPoct/wat | 1.727 | Crippen Calculated Property | |
| McVol | 66.150 | ml/mol | McGowan Calculated Property |
| Pc | [4800.00; 4802.00] | kPa |
|
| Pc | 4800.00 | kPa | KDB |
| Pc | 4800.00 ± 50.00 | kPa | NIST |
| Pc | 4802.00 ± 30.00 | kPa | NIST |
| ρc | [277.92; 277.92] | kg/m3 |
|
| ρc | 277.92 ± 3.41 | kg/m3 | NIST |
| ρc | 277.92 ± 6.13 | kg/m3 | NIST |
| Inp | [540.00; 581.00] |
|
|
| Inp | 561.00 | NIST | |
| Inp | 560.00 | NIST | |
| Inp | 562.30 | NIST | |
| Inp | 547.70 | NIST | |
| Inp | Outlier 569.50 | NIST | |
| Inp | 566.50 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | 550.10 | NIST | |
| Inp | 562.00 | NIST | |
| Inp | 559.00 | NIST | |
| Inp | 561.00 | NIST | |
| Inp | 560.00 | NIST | |
| Inp | 554.00 | NIST | |
| Inp | 554.00 | NIST | |
| Inp | 565.00 | NIST | |
| Inp | 564.00 | NIST | |
| Inp | 558.00 | NIST | |
| Inp | 549.30 | NIST | |
| Inp | 549.50 | NIST | |
| Inp | 551.40 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | 547.00 | NIST | |
| Inp | 545.00 | NIST | |
| Inp | 548.00 | NIST | |
| Inp | 553.00 | NIST | |
| Inp | 551.00 | NIST | |
| Inp | 551.00 | NIST | |
| Inp | 555.00 | NIST | |
| Inp | 549.62 | NIST | |
| Inp | 548.20 | NIST | |
| Inp | 560.00 | NIST | |
| Inp | 557.90 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 552.00 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | Outlier 572.00 | NIST | |
| Inp | 545.48 | NIST | |
| Inp | 561.80 | NIST | |
| Inp | 549.60 | NIST | |
| Inp | 550.70 | NIST | |
| Inp | 555.50 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 551.00 | NIST | |
| Inp | 556.00 | NIST | |
| Inp | 560.00 | NIST | |
| Inp | 556.00 | NIST | |
| Inp | 547.00 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 553.00 | NIST | |
| Inp | 556.00 | NIST | |
| Inp | 559.00 | NIST | |
| Inp | 554.00 | NIST | |
| Inp | 552.00 | NIST | |
| Inp | 565.00 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | 553.00 | NIST | |
| Inp | 543.00 | NIST | |
| Inp | 552.00 | NIST | |
| Inp | 552.00 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 548.00 | NIST | |
| Inp | 556.00 | NIST | |
| Inp | 543.00 | NIST | |
| Inp | 548.00 | NIST | |
| Inp | 545.00 | NIST | |
| Inp | 558.00 | NIST | |
| Inp | 560.00 | NIST | |
| Inp | 557.00 | NIST | |
| Inp | Outlier 581.00 | NIST | |
| Inp | Outlier 569.00 | NIST | |
| Inp | 555.00 | NIST | |
| Inp | 554.00 | NIST | |
| Inp | Outlier 540.00 | NIST | |
| Inp | 558.00 | NIST | |
| Inp | 555.00 | NIST | |
| Inp | 547.00 | NIST | |
| Inp | 555.00 | NIST | |
| Inp | 547.00 | NIST | |
| Inp | 558.00 | NIST | |
| Inp | 555.00 | NIST | |
| Inp | 547.00 | NIST | |
| Inp | 550.00 | NIST | |
| Inp | 548.00 | NIST | |
| Inp | 561.00 | NIST | |
| Inp | 566.50 | NIST | |
| Inp | 562.00 | NIST | |
| Inp | 554.00 | NIST | |
| Inp | 549.50 | NIST | |
| Inp | 549.62 | NIST | |
| Inp | 552.00 | NIST | |
| Inp | 549.60 | NIST | |
| Inp | 556.00 | NIST | |
| Inp | 553.00 | NIST | |
| Inp | 565.00 | NIST | |
| I | [663.00; 705.00] |
|
|
| I | 705.00 | NIST | |
| I | 693.00 | NIST | |
| I | 701.00 | NIST | |
| I | 705.00 | NIST | |
| I | 704.90 | NIST | |
| I | 693.30 | NIST | |
| I | 700.70 | NIST | |
| I | 704.40 | NIST | |
| I | 693.30 | NIST | |
| I | 700.70 | NIST | |
| I | Outlier 663.00 | NIST | |
| I | 705.00 | NIST | |
| I | 693.30 | NIST | |
| I | Outlier 663.00 | NIST | |
| S°gas | 289.66 | J/mol×K | NIST |
| S°liquid | 201.25 | J/mol×K | NIST |
| Tboil | [315.00; 320.00] | K |
|
| Tboil | 317.39 | K | KDB |
| Tboil | 317.40 | K | NIST |
| Tboil | 317.00 ± 1.00 | K | NIST |
| Tboil | 318.12 ± 0.02 | K | NIST |
| Tboil | 316.00 ± 3.00 | K | NIST |
| Tboil | 317.00 ± 2.00 | K | NIST |
| Tboil | 317.40 ± 2.00 | K | NIST |
| Tboil | 317.55 ± 0.20 | K | NIST |
| Tboil | 316.00 ± 5.00 | K | NIST |
| Tboil | Outlier 320.00 ± 4.00 | K | NIST |
| Tboil | 317.00 ± 4.00 | K | NIST |
| Tboil | Outlier 315.00 ± 3.00 | K | NIST |
| Tboil | 317.00 ± 1.50 | K | NIST |
| Tboil | 317.50 ± 1.00 | K | NIST |
| Tboil | 317.40 ± 0.40 | K | NIST |
| Tboil | 317.39 ± 0.10 | K | NIST |
| Tboil | 317.30 ± 1.00 | K | NIST |
| Tboil | 317.60 ± 1.50 | K | NIST |
| Tboil | 317.00 ± 2.00 | K | NIST |
| Tboil | 317.55 ± 0.25 | K | NIST |
| Tboil | 317.38 ± 0.20 | K | NIST |
| Tboil | 317.40 ± 0.20 | K | NIST |
| Tboil | 317.17 ± 0.20 | K | NIST |
| Tboil | 317.50 ± 0.50 | K | NIST |
| Tboil | 317.50 ± 0.50 | K | NIST |
| Tboil | 317.30 ± 1.50 | K | NIST |
| Tboil | 316.90 ± 0.60 | K | NIST |
| Tboil | 319.00 ± 2.00 | K | NIST |
| Tboil | 319.00 ± 2.00 | K | NIST |
| Tc | [506.10; 507.60] | K |
|
| Tc | 506.50 | K | KDB |
| Tc | 506.50 ± 0.50 | K | NIST |
| Tc | 507.60 ± 0.40 | K | NIST |
| Tc | 507.00 ± 0.60 | K | NIST |
| Tc | 506.10 ± 0.15 | K | NIST |
| Tfus | [137.99; 139.50] | K |
|
| Tfus | 138.00 | K | KDB |
| Tfus | 138.12 | K | Aq. Solubility Prediction |
| Tfus | 138.07 ± 0.01 | K | NIST |
| Tfus | 139.50 ± 0.50 | K | NIST |
| Tfus | 139.50 ± 0.50 | K | NIST |
| Tfus | 138.06 ± 0.10 | K | NIST |
| Tfus | 138.06 ± 0.04 | K | NIST |
| Tfus | 138.08 ± 0.02 | K | NIST |
| Tfus | 138.08 ± 0.20 | K | NIST |
| Tfus | 137.99 ± 0.20 | K | NIST |
| Ttriple | [138.13; 138.13] | K |
|
| Ttriple | 138.13 ± 0.05 | K | NIST |
| Ttriple | 138.13 ± 0.05 | K | NIST |
| Vc | [0.245; 0.245] | m3/kmol |
|
| Vc | 0.245 | m3/kmol | KDB |
| Vc | 0.245 | m3/kmol | NIST |
| Zc | 0.2792490 | KDB |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [228.71; 338.98] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.43557e+01 | |||
| Coefficient B | -2.79261e+03 | |||
| Coefficient C | -3.02070e+01 | |||
| Temperature range, min. | 228.71 | |||
| Temperature range, max. | 338.98 | |||
| Pvap | 1.33 | kPa | 228.71 | Calculated Property |
| Pvap | 3.02 | kPa | 240.96 | Calculated Property |
| Pvap | 6.25 | kPa | 253.21 | Calculated Property |
| Pvap | 12.01 | kPa | 265.47 | Calculated Property |
| Pvap | 21.61 | kPa | 277.72 | Calculated Property |
| Pvap | 36.79 | kPa | 289.97 | Calculated Property |
| Pvap | 59.70 | kPa | 302.22 | Calculated Property |
| Pvap | 92.93 | kPa | 314.48 | Calculated Property |
| Pvap | 139.46 | kPa | 326.73 | Calculated Property |
| Pvap | 202.65 | kPa | 338.98 | Calculated Property |
| Pvap | [1.03e-05; 4785.72] | kPa | [138.13; 507.00] |
KDB Vapor Pressure Data
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 6.73094e+01 | |||
| Coefficient B | -5.41966e+03 | |||
| Coefficient C | -8.05798e+00 | |||
| Coefficient D | 7.94719e-06 | |||
| Temperature range, min. | 138.13 | |||
| Temperature range, max. | 507.00 | |||
| Pvap | 1.03e-05 | kPa | 138.13 | Calculated Property |
| Pvap | 0.01 | kPa | 179.12 | Calculated Property |
| Pvap | 0.67 | kPa | 220.10 | Calculated Property |
| Pvap | 9.50 | kPa | 261.09 | Calculated Property |
| Pvap | 58.94 | kPa | 302.07 | Calculated Property |
| Pvap | 222.51 | kPa | 343.06 | Calculated Property |
| Pvap | 613.02 | kPa | 384.04 | Calculated Property |
| Pvap | 1374.27 | kPa | 425.03 | Calculated Property |
| Pvap | 2685.32 | kPa | 466.01 | Calculated Property |
| Pvap | 4785.72 | kPa | 507.00 | Calculated Property |
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