- InChI
- InChI=1S/C17H36O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-17(2)3/h17H,4-16H2,1-3H3
- InChI Key
- ULTRPZHREZRMJX-UHFFFAOYSA-N
- Formula
- C17H36O
- SMILES
- CCCCCCCCCCCCCCOC(C)C
- Molecular Weight1
- 256.47
- 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 | 0.7749 | Relay (1.0) Calculated Property | |
| ΔfG° | -15.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -539.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.112 | Crippen Calculated Property | |
| McVol | 256.260 | ml/mol | McGowan Calculated Property |
| Pc | 1223.41 | kPa | Joback Calculated Property |
| Inp | [1730.00; 1730.00] |
|
|
| Inp | 1730.00 | NIST | |
| Inp | 1730.00 | NIST | |
| Tboil | 552.03 | K | Relay (1.0) Calculated Property |
| Tc | 716.41 | K | Relay (1.0) Calculated Property |
| Tfus | 270.74 | K | Relay (1.0) Calculated Property |
| Vc | 1.014 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [381.21; 915.41] | 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 | 1.12530e+01 | |||
| Coefficient B | 1.56156e+00 | |||
| Coefficient C | -7.93200e-04 | |||
| Coefficient D | 1.35800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 381.21 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 470.44 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 551.19 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 623.91 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 689.02 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 746.94 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 798.12 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 842.97 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 881.92 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 915.41 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0044218; 0.0001560] | Pa×s | [288.58; 540.45] |
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 | -1.25980e+01 | |||
| Coefficient B | 2.07107e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 288.58 | |||
| Temperature range, max. | 540.45 | |||
| η | 0.0044218 | Pa×s | 288.58 | Calculated Property |
| η | 0.0023446 | Pa×s | 316.57 | Calculated Property |
| η | 0.0013781 | Pa×s | 344.55 | Calculated Property |
| η | 0.0008774 | Pa×s | 372.54 | Calculated Property |
| η | 0.0005950 | Pa×s | 400.52 | Calculated Property |
| η | 0.0004244 | Pa×s | 428.51 | Calculated Property |
| η | 0.0003156 | Pa×s | 456.49 | Calculated Property |
| η | 0.0002428 | Pa×s | 484.48 | Calculated Property |
| η | 0.0001923 | Pa×s | 512.46 | Calculated Property |
| η | 0.0001560 | Pa×s | 540.45 | Calculated Property |
Similar Compounds
Find more compounds similar to Isopropyl tetradecyl ether.
Sources
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