- InChI
- InChI=1S/C18H36O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21-4-2/h17,19H,3-16H2,1-2H3
- InChI Key
- LTSBJVJXSJSRRZ-UHFFFAOYSA-N
- Formula
- C18H36O3
- SMILES
- CCCCCCCCCCCCCC(O)CC(=O)OCC
- Molecular Weight1
- 300.48
- CAS
- 105918-27-2
- 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).
- 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 | 1.0326 | Relay (... Calculated Property | |
| ΔfG° | -272.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -916.74 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 45.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.77 | kJ/mol | Relay (... Calculated Property |
| IE | 9.90 | eV | Relay (... Calculated Property |
| log10WS | -4.96 | Relay (... Calculated Property | |
| logPoct/wat | 5.002 | Crippen Calculated Property | |
| McVol | 277.790 | ml/mol | McGowan Calculated Property |
| Pc | 1275.51 | kPa | Joback Calculated Property |
| Inp | [2142.30; 2142.30] |
|
|
| Inp | 2142.30 | NIST | |
| Inp | 2142.30 | NIST | |
| Tboil | 597.63 | K | Relay (... Calculated Property |
| Tc | 786.30 | K | Relay (... Calculated Property |
| Tfus | 323.07 | K | Relay (... Calculated Property |
| Vc | 1.074 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [867.00; 956.90] | J/mol×K | [779.27; 956.35] |
|
| Cp,gas | 867.00 | J/mol×K | 779.27 | Joback Calculated Property |
| Cp,gas | 884.08 | J/mol×K | 808.78 | Joback Calculated Property |
| Cp,gas | 900.29 | J/mol×K | 838.30 | Joback Calculated Property |
| Cp,gas | 915.65 | J/mol×K | 867.81 | Joback Calculated Property |
| Cp,gas | 930.20 | J/mol×K | 897.33 | Joback Calculated Property |
| Cp,gas | 943.94 | J/mol×K | 926.84 | Joback Calculated Property |
| Cp,gas | 956.90 | J/mol×K | 956.35 | Joback Calculated Property |
| η | [0.0000163; 0.0019004] | Pa×s | [410.60; 779.27] |
|
| η | 0.0019004 | Pa×s | 410.60 | Joback Calculated Property |
| η | 0.0005130 | Pa×s | 472.05 | Joback Calculated Property |
| η | 0.0001872 | Pa×s | 533.49 | Joback Calculated Property |
| η | 0.0000841 | Pa×s | 594.93 | Joback Calculated Property |
| η | 0.0000439 | Pa×s | 656.38 | Joback Calculated Property |
| η | 0.0000256 | Pa×s | 717.83 | Joback Calculated Property |
| η | 0.0000163 | Pa×s | 779.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl 3-hydroxyhexadecanoate.
Sources
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