- InChI
- InChI=1S/C14H30O/c1-3-5-7-9-10-12-14-15-13-11-8-6-4-2/h3-14H2,1-2H3
- InChI Key
- KUTWKGLRMXBROO-UHFFFAOYSA-N
- Formula
- C14H30O
- SMILES
- CCCCCCCCOCCCCCC
- Molecular Weight1
- 214.39
- 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 | 0.7096 | Relay (1.0) Calculated Property | |
| ΔfG° | -38.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -461.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.944 | Crippen Calculated Property | |
| McVol | 213.990 | ml/mol | McGowan Calculated Property |
| Pc | 1503.48 | kPa | Joback Calculated Property |
| Tboil | 530.70 ± 2.00 | K | NIST |
| Tc | 704.09 | K | Relay (1.0) Calculated Property |
| Tfus | 246.20 ± 1.50 | K | NIST |
| Vc | 0.847 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [317.88; 760.10] | 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 | 1.56620e+01 | |||
| Coefficient B | 1.27064e+00 | |||
| Coefficient C | -6.26800e-04 | |||
| Coefficient D | 1.00600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 317.88 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 391.19 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 457.72 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 517.77 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 571.68 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 619.76 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 662.32 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 699.68 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 732.17 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 760.10 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0071903; 0.0002067] | Pa×s | [246.20; 491.50] |
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 | -1.20462e+01 | |||
| Coefficient B | 1.75077e+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. | 246.20 | |||
| Temperature range, max. | 491.50 | |||
| η | 0.0071903 | Pa×s | 246.20 | Calculated Property |
| η | 0.0035394 | Pa×s | 273.46 | Calculated Property |
| η | 0.0019812 | Pa×s | 300.71 | Calculated Property |
| η | 0.0012212 | Pa×s | 327.97 | Calculated Property |
| η | 0.0008108 | Pa×s | 355.22 | Calculated Property |
| η | 0.0005707 | Pa×s | 382.48 | Calculated Property |
| η | 0.0004209 | Pa×s | 409.73 | Calculated Property |
| η | 0.0003224 | Pa×s | 436.99 | Calculated Property |
| η | 0.0002548 | Pa×s | 464.24 | Calculated Property |
| η | 0.0002067 | Pa×s | 491.50 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexyl octyl ether.
Sources
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