| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 898.80 | kJ/mol | NIST |
| BasG | 866.40 | kJ/mol | NIST |
| ΔcH°liquid | [-1305.20; -1305.20] | kJ/mol |
|
| ΔcH°liquid | -1305.20 ± 0.59 | kJ/mol | NIST |
| ΔcH°liquid | -1305.20 | kJ/mol | NIST |
| ΔfH°gas | 94.50 | kJ/mol | NIST |
| ΔfH°liquid | 54.14 | kJ/mol | NIST |
| ΔfusH° | 8.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [40.37; 40.50] | kJ/mol |
|
| ΔvapH° | 40.50 | kJ/mol | NIST |
| ΔvapH° | 40.37 | kJ/mol | NIST |
| ΔvapH° | 40.37 | kJ/mol | NIST |
| IE | [7.67; 9.36] | eV |
|
| IE | 7.70 ± 0.15 | eV | NIST |
| IE | 7.70 ± 0.15 | eV | NIST |
| IE | 8.67 | eV | NIST |
| IE | 8.00 ± 0.06 | eV | NIST |
| IE | 7.67 ± 0.02 | eV | NIST |
| IE | 8.60 ± 0.10 | eV | NIST |
| IE | 8.40 ± 0.05 | eV | NIST |
| IE | 9.34 | eV | NIST |
| IE | 9.36 | eV | NIST |
| IE | 9.32 | eV | NIST |
| log10WS | [1.34; 1.34] |
|
|
| log10WS | 1.34 | Aq. Solubility Prediction | |
| log10WS | 1.34 | Estimated Solubility | |
| logPoct/wat | -0.920 | Crippen Calculated Property | |
| McVol | 44.910 | ml/mol | McGowan Calculated Property |
| Pc | 6461.89 | kPa | Joback Calculated Property |
| S°liquid | 165.94 | J/mol×K | NIST |
| Tboil | 364.00 | K | NIST |
| Tc | 571.90 | K | Relay (1.0) Calculated Property |
| Tfus | 236.45 | K | Aq. Solubility Prediction |
| Ttriple | 220.79 ± 0.02 | K | NIST |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [75.35; 102.35] | J/mol×K | [345.18; 535.23] | |
| Cp,gas | 75.35 | J/mol×K | 345.18 | Joback Calculated Property |
| Cp,gas | 80.32 | J/mol×K | 376.86 | Joback Calculated Property |
| Cp,gas | 85.10 | J/mol×K | 408.53 | Joback Calculated Property |
| Cp,gas | 89.69 | J/mol×K | 440.21 | Joback Calculated Property |
| Cp,gas | 94.09 | J/mol×K | 471.88 | Joback Calculated Property |
| Cp,gas | 98.31 | J/mol×K | 503.56 | Joback Calculated Property |
| Cp,gas | 102.35 | J/mol×K | 535.23 | Joback Calculated Property |
| Cp,liquid | 134.93 | J/mol×K | 298.15 | NIST |
| ΔfusH | [10.42; 10.42] | kJ/mol | [220.79; 220.80] | |
| ΔfusH | 10.42 | kJ/mol | 220.79 | NIST |
| ΔfusH | 10.42 | kJ/mol | 220.79 | NIST |
| ΔfusH | 10.42 | kJ/mol | 220.80 | NIST |
| ΔfusH | 10.42 | kJ/mol | 220.80 | NIST |
| ΔvapH | [36.12; 41.80] | kJ/mol | [286.50; 364.00] | |
| ΔvapH | 41.80 | kJ/mol | 286.50 | NIST |
| ΔvapH | 41.80 | kJ/mol | 286.50 | NIST |
| ΔvapH | 40.37 | kJ/mol | 298.15 | NIST |
| ΔvapH | 40.37 | kJ/mol | 298.15 | NIST |
| ΔvapH | 36.12 | kJ/mol | 364.00 | NIST |
| ΔfusS | [47.19; 47.19] | J/mol×K | [220.79; 220.79] | |
| ΔfusS | 47.19 | J/mol×K | 220.79 | NIST |
| ΔfusS | 47.19 | J/mol×K | 220.79 | NIST |
| ΔvapS | [135.39; 135.39] | J/mol×K | [298.15; 298.15] | |
| ΔvapS | 135.39 | J/mol×K | 298.15 | NIST |
| ΔvapS | 135.39 | J/mol×K | 298.15 | NIST |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 206.93] | kPa | [272.42; 388.91] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.30982e+01 | |||
| Coefficient B | -2.29728e+03 | |||
| Coefficient C | -9.30910e+01 | |||
| Temperature range, min. | 272.42 | |||
| Temperature range, max. | 388.91 | |||
| Pvap | 1.33 | kPa | 272.42 | Calculated Property |
| Pvap | 3.16 | kPa | 285.36 | Calculated Property |
| Pvap | 6.71 | kPa | 298.31 | Calculated Property |
| Pvap | 13.04 | kPa | 311.25 | Calculated Property |
| Pvap | 23.52 | kPa | 324.19 | Calculated Property |
| Pvap | 39.84 | kPa | 337.14 | Calculated Property |
| Pvap | 64.01 | kPa | 350.08 | Calculated Property |
| Pvap | 98.26 | kPa | 363.02 | Calculated Property |
| Pvap | 145.05 | kPa | 375.97 | Calculated Property |
| Pvap | 206.93 | kPa | 388.91 | Calculated Property |
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