| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3018 | Relay (1.0) Calculated Property | |
| ΔcH°liquid | [-6356.80; -6341.30] | kJ/mol |
|
| ΔcH°liquid | -6342.90 ± 4.20 | kJ/mol | NIST |
| ΔcH°liquid | -6350.50 ± 6.30 | kJ/mol | NIST |
| ΔcH°liquid | -6356.80 ± 3.20 | kJ/mol | NIST |
| ΔcH°liquid | -6341.30 ± 7.10 | kJ/mol | NIST |
| ΔfG° | 30.41 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | [-164.90; -142.90] | kJ/mol |
|
| ΔfH°gas | -142.90 ± 3.90 | kJ/mol | NIST |
| ΔfH°gas | -158.40 ± 7.50 | kJ/mol | NIST |
| ΔfH°gas | -164.90 ± 6.50 | kJ/mol | NIST |
| ΔfH°gas | -156.80 ± 4.80 | kJ/mol | NIST |
| ΔfH°liquid | [-210.60; -188.60] | kJ/mol |
|
| ΔfH°liquid | -188.60 ± 3.90 | kJ/mol | NIST |
| ΔfH°liquid | -204.10 ± 7.50 | kJ/mol | NIST |
| ΔfH°liquid | -210.60 ± 6.50 | kJ/mol | NIST |
| ΔfH°liquid | -202.50 ± 4.80 | kJ/mol | NIST |
| ΔvapH° | [45.70; 45.70] | kJ/mol |
|
| ΔvapH° | 45.70 ± 0.40 | kJ/mol | NIST |
| ΔvapH° | 45.70 ± 0.40 | kJ/mol | NIST |
| IE | [8.90; 9.80] | eV |
|
| IE | 8.90 | eV | NIST |
| IE | 9.80 | eV | NIST |
| IE | 9.30 | eV | NIST |
| log10WS | -3.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.515 | Crippen Calculated Property | |
| Pc | 2515.71 | kPa | Relay (1.0-beta) Calculated Property |
| S°liquid | 428.80 | J/mol×K | NIST |
| Tboil | 435.40 ± 0.50 | K | NIST |
| Tc | 634.90 | K | Relay (1.0) Calculated Property |
| Tfus | 180.47 ± 0.20 | K | NIST |
| Ttriple | [179.99; 180.30] | K |
|
| Ttriple | 179.99 ± 0.02 | K | NIST |
| Ttriple | 180.30 ± 0.20 | K | NIST |
| Vc | 0.481 | m3/kmol | Relay (1.0) Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [294.70; 309.60] | J/mol×K | [298.15; 298.15] | |
| Cp,liquid | 294.70 | J/mol×K | 298.15 | NIST |
| Cp,liquid | 309.60 | J/mol×K | 298.15 | NIST |
| ΔfusH | [12.31; 12.62] | kJ/mol | [179.99; 180.47] | |
| ΔfusH | 12.31 | kJ/mol | 179.99 | NIST |
| ΔfusH | 12.62 | kJ/mol | 180.30 | NIST |
| ΔfusH | 12.31 | kJ/mol | 180.30 | NIST |
| ΔfusH | 12.31 | kJ/mol | 180.30 | NIST |
| ΔfusH | 12.41 | kJ/mol | 180.47 | NIST |
| ΔvapH | [43.40; 46.10] | kJ/mol | [273.00; 386.50] | |
| ΔvapH | 43.40 | kJ/mol | 273.00 | NIST |
| ΔvapH | 46.10 | kJ/mol | 386.50 | NIST |
| ΔfusS | [68.00; 70.00] | J/mol×K | [179.99; 180.47] | |
| ΔfusS | 68.00 | J/mol×K | 179.99 | NIST |
| ΔfusS | 70.00 | J/mol×K | 180.30 | NIST |
| ΔfusS | 68.74 | J/mol×K | 180.47 | NIST |
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