- InChI
- InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-13-16-19(20)21-17-18-14-11-10-12-15-18/h18H,2-17H2,1H3
- InChI Key
- VHTNBSNRTWIBSL-UHFFFAOYSA-N
- Formula
- C19H36O2
- SMILES
- CCCCCCCCCCCC(=O)OCC1CCCCC1
- Molecular Weight1
- 296.49
- 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 | 0.8245 | Relay (1.0) Calculated Property | |
| ΔfG° | -176.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -717.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.25 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.031 | Crippen Calculated Property | |
| McVol | 275.150 | ml/mol | McGowan Calculated Property |
| Pc | 1246.85 | kPa | Joback Calculated Property |
| Inp | [2163.00; 2163.00] |
|
|
| Inp | 2163.00 | NIST | |
| Inp | 2163.00 | NIST | |
| Tboil | 619.36 | K | Relay (1.0) Calculated Property |
| Tc | 810.28 | K | Relay (1.0) Calculated Property |
| Tfus | 268.34 | K | Relay (1.0) Calculated Property |
| Vc | 1.034 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [386.76; 992.74] | 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 | -5.45790e+01 | |||
| Coefficient B | 1.87612e+00 | |||
| Coefficient C | -9.96200e-04 | |||
| Coefficient D | 1.67400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 386.76 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 491.88 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 586.32 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 670.60 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 745.26 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 810.83 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 867.83 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 916.79 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 958.26 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 992.74 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0032408; 0.0001286] | Pa×s | [353.60; 627.59] |
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 | -1.31230e+01 | |||
| Coefficient B | 2.61347e+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. | 353.60 | |||
| Temperature range, max. | 627.59 | |||
| η | 0.0032408 | Pa×s | 353.60 | Calculated Property |
| η | 0.0018039 | Pa×s | 384.04 | Calculated Property |
| η | 0.0010943 | Pa×s | 414.49 | Calculated Property |
| η | 0.0007108 | Pa×s | 444.93 | Calculated Property |
| η | 0.0004880 | Pa×s | 475.37 | Calculated Property |
| η | 0.0003505 | Pa×s | 505.82 | Calculated Property |
| η | 0.0002614 | Pa×s | 536.26 | Calculated Property |
| η | 0.0002012 | Pa×s | 566.71 | Calculated Property |
| η | 0.0001590 | Pa×s | 597.15 | Calculated Property |
| η | 0.0001286 | Pa×s | 627.59 | Calculated Property |
Similar Compounds
Find more compounds similar to Lauric acid, cyclohexylmethyl ester.
Sources
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