- InChI
- InChI=1S/C18H38O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18(19-5-2)20-6-3/h18H,4-17H2,1-3H3
- InChI Key
- YUNMFLYGTASHSJ-UHFFFAOYSA-N
- Formula
- C18H38O2
- SMILES
- CCCCCCCCCCCCCC(OCC)OCC
- Molecular Weight1
- 286.50
- 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).
- I : 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 | 0.8175 | Relay (1.0) Calculated Property | |
| ΔfG° | -111.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -699.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.48 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.087 | Crippen Calculated Property | |
| McVol | 276.220 | ml/mol | McGowan Calculated Property |
| Pc | 1132.15 | kPa | Joback Calculated Property |
| I | [2035.00; 2035.00] |
|
|
| I | 2035.00 | NIST | |
| I | 2035.00 | NIST | |
| Tboil | 573.38 | K | Relay (1.0) Calculated Property |
| Tc | 730.00 | K | Relay (1.0) Calculated Property |
| Tfus | 249.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.079 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [417.82; 985.50] | 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 | 3.58440e+01 | |||
| Coefficient B | 1.59336e+00 | |||
| Coefficient C | -7.36600e-04 | |||
| Coefficient D | 9.29000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 417.82 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 511.46 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 596.77 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 674.05 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 743.59 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 805.69 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 860.63 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 908.72 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 950.25 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 985.50 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0025528; 0.0001138] | Pa×s | [322.08; 573.12] |
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 | -1.30723e+01 | |||
| Coefficient B | 2.28732e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 322.08 | |||
| Temperature range, max. | 573.12 | |||
| η | 0.0025528 | Pa×s | 322.08 | Calculated Property |
| η | 0.0014495 | Pa×s | 349.97 | Calculated Property |
| η | 0.0008947 | Pa×s | 377.87 | Calculated Property |
| η | 0.0005901 | Pa×s | 405.76 | Calculated Property |
| η | 0.0004107 | Pa×s | 433.65 | Calculated Property |
| η | 0.0002986 | Pa×s | 461.55 | Calculated Property |
| η | 0.0002251 | Pa×s | 489.44 | Calculated Property |
| η | 0.0001750 | Pa×s | 517.33 | Calculated Property |
| η | 0.0001395 | Pa×s | 545.23 | Calculated Property |
| η | 0.0001138 | Pa×s | 573.12 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,1-diethoxytetradecane.
Sources
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