- InChI
- InChI=1S/C18H38O/c1-3-5-7-9-11-12-14-16-18-19-17-15-13-10-8-6-4-2/h3-18H2,1-2H3
- InChI Key
- BTWPHTDACLVGMG-UHFFFAOYSA-N
- Formula
- C18H38O
- SMILES
- CCCCCCCCCCOCCCCCCCC
- Molecular Weight1
- 270.50
- 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).
- 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 | 0.8505 | Relay (1.0) Calculated Property | |
| ΔfG° | -4.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -545.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.93 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.504 | Crippen Calculated Property | |
| McVol | 270.350 | ml/mol | McGowan Calculated Property |
| Pc | 1139.03 | kPa | Joback Calculated Property |
| Inp | [1862.00; 1862.00] |
|
|
| Inp | 1862.00 | NIST | |
| Inp | 1862.00 | NIST | |
| Tboil | 570.58 | K | Relay (1.0) Calculated Property |
| Tc | 746.91 | K | Relay (1.0) Calculated Property |
| Tfus | 268.86 | K | Relay (1.0) Calculated Property |
| Vc | 1.078 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [402.73; 966.47] | 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 | 1.20260e+01 | |||
| Coefficient B | 1.65064e+00 | |||
| Coefficient C | -8.44400e-04 | |||
| Coefficient D | 1.48200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 402.73 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 496.86 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 582.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 658.69 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 727.33 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 788.40 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 842.38 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 889.74 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 930.95 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 966.47 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0028718; 0.0001536] | Pa×s | [314.85; 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 | -1.26097e+01 | |||
| Coefficient B | 2.12741e+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. | 314.85 | |||
| Temperature range, max. | 555.63 | |||
| η | 0.0028718 | Pa×s | 314.85 | Calculated Property |
| η | 0.0016917 | Pa×s | 341.60 | Calculated Property |
| η | 0.0010762 | Pa×s | 368.36 | Calculated Property |
| η | 0.0007279 | Pa×s | 395.11 | Calculated Property |
| η | 0.0005173 | Pa×s | 421.86 | Calculated Property |
| η | 0.0003830 | Pa×s | 448.62 | Calculated Property |
| η | 0.0002933 | Pa×s | 475.37 | Calculated Property |
| η | 0.0002310 | Pa×s | 502.12 | Calculated Property |
| η | 0.0001865 | Pa×s | 528.88 | Calculated Property |
| η | 0.0001536 | Pa×s | 555.63 | Calculated Property |
Similar Compounds
Find more compounds similar to Decyl octyl ether.
Sources
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