- InChI
- InChI=1S/C18H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h3-4,19H,2,5-18H2,1H3/b4-3-
- InChI Key
- KQYJOJHRIVABRB-ARJAWSKDSA-N
- Formula
- C18H36O
- SMILES
- CCC=CCCCCCCCCCCCCCCO
- Molecular Weight1
- 268.48
- 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.
- 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 | 0.9818 | Relay (1.0) Calculated Property | |
| ΔfG° | 44.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -496.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.016 | Crippen Calculated Property | |
| McVol | 266.050 | ml/mol | McGowan Calculated Property |
| Pc | 1273.69 | kPa | Joback Calculated Property |
| Inp | [2087.00; 2087.00] |
|
|
| Inp | 2087.00 | NIST | |
| Inp | 2087.00 | NIST | |
| I | [2150.00; 2150.00] |
|
|
| I | 2150.00 | NIST | |
| I | 2150.00 | NIST | |
| Tboil | 604.30 | K | Relay (1.0) Calculated Property |
| Tc | 786.17 | K | Relay (1.0) Calculated Property |
| Tfus | 308.19 | K | Relay (1.0) Calculated Property |
| Vc | 1.012 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [385.83; 936.06] | 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 | -2.23650e+01 | |||
| Coefficient B | 1.76782e+00 | |||
| Coefficient C | -1.06960e-03 | |||
| Coefficient D | 2.60200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 385.83 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 480.70 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 565.22 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 640.21 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 706.49 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 764.88 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 816.21 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 861.30 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 900.98 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 936.06 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0053551; 0.0000551] | Pa×s | [348.36; 611.98] |
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 | -1.58542e+01 | |||
| Coefficient B | 3.70115e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 348.36 | |||
| Temperature range, max. | 611.98 | |||
| η | 0.0053551 | Pa×s | 348.36 | Calculated Property |
| η | 0.0023490 | Pa×s | 377.65 | Calculated Property |
| η | 0.0011602 | Pa×s | 406.94 | Calculated Property |
| η | 0.0006300 | Pa×s | 436.23 | Calculated Property |
| η | 0.0003694 | Pa×s | 465.52 | Calculated Property |
| η | 0.0002307 | Pa×s | 494.81 | Calculated Property |
| η | 0.0001519 | Pa×s | 524.11 | Calculated Property |
| η | 0.0001045 | Pa×s | 553.40 | Calculated Property |
| η | 0.0000747 | Pa×s | 582.69 | Calculated Property |
| η | 0.0000551 | Pa×s | 611.98 | Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-15-Octadecen-1-ol.
Sources
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