- InChI
- InChI=1S/C15H32O4/c1-3-4-5-6-7-8-9-17-12-13-19-15-14-18-11-10-16-2/h3-15H2,1-2H3
- InChI Key
- MQXJDGPAODOSSZ-UHFFFAOYSA-N
- Formula
- C15H32O4
- SMILES
- CCCCCCCCOCCOCCOCCOC
- Molecular Weight1
- 276.41
- 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 | 0.8459 | Relay (1.0) Calculated Property | |
| ΔfG° | -344.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -834.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.043 | Crippen Calculated Property | |
| McVol | 245.690 | ml/mol | McGowan Calculated Property |
| Pc | 1345.70 | kPa | Joback Calculated Property |
| Inp | 1880.00 | NIST | |
| Tboil | 582.64 | K | Relay (1.0) Calculated Property |
| Tc | 740.27 | K | Relay (1.0) Calculated Property |
| Tfus | 238.05 | K | Relay (1.0) Calculated Property |
| Vc | 0.956 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [385.30; 867.19] | 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 | 9.12530e+01 | |||
| Coefficient B | 1.17604e+00 | |||
| Coefficient C | -3.48200e-04 | |||
| Coefficient D | -5.19000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 385.30 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 461.43 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 532.30 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 597.73 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 657.58 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 711.67 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 759.84 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 801.93 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 837.77 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 867.19 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0011248; 0.0001042] | Pa×s | [347.73; 555.63] |
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 | -1.31491e+01 | |||
| Coefficient B | 2.21120e+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. | 347.73 | |||
| Temperature range, max. | 555.63 | |||
| η | 0.0011248 | Pa×s | 347.73 | Calculated Property |
| η | 0.0007569 | Pa×s | 370.83 | Calculated Property |
| η | 0.0005336 | Pa×s | 393.93 | Calculated Property |
| η | 0.0003910 | Pa×s | 417.03 | Calculated Property |
| η | 0.0002960 | Pa×s | 440.13 | Calculated Property |
| η | 0.0002304 | Pa×s | 463.23 | Calculated Property |
| η | 0.0001837 | Pa×s | 486.33 | Calculated Property |
| η | 0.0001494 | Pa×s | 509.43 | Calculated Property |
| η | 0.0001238 | Pa×s | 532.53 | Calculated Property |
| η | 0.0001042 | Pa×s | 555.63 | Calculated Property |
Similar Compounds
Find more compounds similar to Triethylene glycol, methyl-octyl ether.
Sources
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