- InChI
- InChI=1S/C10H20O3/c1-6-12-10(11)13-9(7(2)3)8(4)5/h7-9H,6H2,1-5H3
- InChI Key
- GTRBOBAVUJEMQK-UHFFFAOYSA-N
- Formula
- C10H20O3
- SMILES
- CCOC(=O)OC(C(C)C)C(C)C
- Molecular Weight1
- 188.26
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5431 | Relay (1.0) Calculated Property | |
| ΔfG° | -389.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -756.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.87 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.840 | Crippen Calculated Property | |
| McVol | 165.070 | ml/mol | McGowan Calculated Property |
| Pc | 2131.49 | kPa | Joback Calculated Property |
| Inp | [1115.00; 1115.00] |
|
|
| Inp | 1115.00 | NIST | |
| Inp | 1115.00 | NIST | |
| Tboil | 472.39 | K | Relay (1.0) Calculated Property |
| Tc | 616.56 | K | Relay (1.0) Calculated Property |
| Tfus | 206.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.600 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [248.42; 563.46] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.96610e+01 | |||
| Coefficient B | 8.53600e-01 | |||
| Coefficient C | -3.24200e-04 | |||
| Coefficient D | -5.60000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 248.42 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 300.82 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 348.92 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 392.69 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 432.11 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 467.18 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 497.86 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 524.15 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 546.02 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 563.46 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0166799; 0.0001759] | Pa×s | [222.02; 480.95] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.25491e+01 | |||
| Coefficient B | 1.87731e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 222.02 | |||
| Temperature range, max. | 480.95 | |||
| η | 0.0166799 | Pa×s | 222.02 | Calculated Property |
| η | 0.0063231 | Pa×s | 250.79 | Calculated Property |
| η | 0.0029266 | Pa×s | 279.56 | Calculated Property |
| η | 0.0015640 | Pa×s | 308.33 | Calculated Property |
| η | 0.0009302 | Pa×s | 337.10 | Calculated Property |
| η | 0.0006003 | Pa×s | 365.87 | Calculated Property |
| η | 0.0004130 | Pa×s | 394.64 | Calculated Property |
| η | 0.0002989 | Pa×s | 423.41 | Calculated Property |
| η | 0.0002254 | Pa×s | 452.18 | Calculated Property |
| η | 0.0001759 | Pa×s | 480.95 | Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethylpentan-3-yl ethyl carbonate.
Sources
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