- InChI
- InChI=1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-14-17-19-18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3
- InChI Key
- CRBREIOFEDVXGE-UHFFFAOYSA-N
- Formula
- C18H30O
- SMILES
- CCCCCCCCCCCCOc1ccccc1
- Molecular Weight1
- 262.43
- CAS
- 35021-68-2
- 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).
- 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 | 0.8159 | Relay (1.0) Calculated Property | |
| ΔfG° | 108.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -307.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.53 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.986 | Crippen Calculated Property | |
| McVol | 246.590 | ml/mol | McGowan Calculated Property |
| Pc | 1443.54 | kPa | Joback Calculated Property |
| Tboil | 593.80 | K | Relay (1.0) Calculated Property |
| Tc | 788.01 | K | Relay (1.0) Calculated Property |
| Tfus | 301.68 | K | Relay (1.0) Calculated Property |
| Vc | 0.952 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [345.48; 847.94] | 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 | -2.18790e+01 | |||
| Coefficient B | 1.57172e+00 | |||
| Coefficient C | -8.75600e-04 | |||
| Coefficient D | 1.73700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 345.48 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 432.26 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 510.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 579.32 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 640.69 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 694.69 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 741.86 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 782.77 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 817.94 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 847.94 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0020452; 0.0001402] | Pa×s | [341.27; 591.80] |
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 | -1.25240e+01 | |||
| Coefficient B | 2.16083e+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. | 341.27 | |||
| Temperature range, max. | 591.80 | |||
| η | 0.0020452 | Pa×s | 341.27 | Calculated Property |
| η | 0.0012687 | Pa×s | 369.11 | Calculated Property |
| η | 0.0008415 | Pa×s | 396.94 | Calculated Property |
| η | 0.0005890 | Pa×s | 424.78 | Calculated Property |
| η | 0.0004308 | Pa×s | 452.62 | Calculated Property |
| η | 0.0003267 | Pa×s | 480.45 | Calculated Property |
| η | 0.0002554 | Pa×s | 508.29 | Calculated Property |
| η | 0.0002048 | Pa×s | 536.12 | Calculated Property |
| η | 0.0001678 | Pa×s | 563.96 | Calculated Property |
| η | 0.0001402 | Pa×s | 591.80 | Calculated Property |
Similar Compounds
Find more compounds similar to Ether, dodecyl phenyl.
Sources
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