- InChI
- InChI=1S/C6H14O3/c1-7-4-6(9-3)5-8-2/h6H,4-5H2,1-3H3
- InChI Key
- CAYMIAFKNJGSOR-UHFFFAOYSA-N
- Formula
- C6H14O3
- SMILES
- COCC(COC)OC
- Molecular Weight1
- 134.18
- Other Names
-
- Glycerol trimethyl ether
- 1,2,3-Trimethyl glycerol triether
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 | 0.4395 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -502.98 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.41 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 0.294 | Crippen Calculated Property | |
| McVol | 113.010 | ml/mol | McGowan Calculated Property |
| Pc | 2963.34 | kPa | Joback Calculated Property |
| Inp | [898.00; 898.00] |
|
|
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Tboil | 426.39 | K | Relay (1.0) Calculated Property |
| Tc | 593.45 | K | Relay (1.0) Calculated Property |
| Tfus | 210.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.411 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [178.66; 384.91] | 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 | 7.22520e+01 | |||
| Coefficient B | 3.90160e-01 | |||
| Coefficient C | 2.72000e-05 | |||
| Coefficient D | -1.04700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 178.66 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 209.05 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 238.34 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 266.21 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 292.32 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 316.34 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 337.94 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 356.79 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 372.56 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 384.91 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0033162; 0.0001768] | Pa×s | [209.07; 401.30] |
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 | -1.18289e+01 | |||
| Coefficient B | 1.27949e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 209.07 | |||
| Temperature range, max. | 401.30 | |||
| η | 0.0033162 | Pa×s | 209.07 | Calculated Property |
| η | 0.0018805 | Pa×s | 230.43 | Calculated Property |
| η | 0.0011741 | Pa×s | 251.79 | Calculated Property |
| η | 0.0007891 | Pa×s | 273.15 | Calculated Property |
| η | 0.0005618 | Pa×s | 294.51 | Calculated Property |
| η | 0.0004188 | Pa×s | 315.87 | Calculated Property |
| η | 0.0003240 | Pa×s | 337.23 | Calculated Property |
| η | 0.0002585 | Pa×s | 358.59 | Calculated Property |
| η | 0.0002115 | Pa×s | 379.94 | Calculated Property |
| η | 0.0001768 | Pa×s | 401.30 | Calculated Property |
Similar Compounds
Find more compounds similar to Propane, 1,2,3-trimethoxy-.
Sources
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