- InChI
- InChI=1S/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(19)20-2/h16,18H,3-15H2,1-2H3
- InChI Key
- LQZITXGTIYKQBJ-UHFFFAOYSA-N
- Formula
- C17H34O3
- SMILES
- CCCCCCCCCCCCCCC(O)C(=O)OC
- Molecular Weight1
- 286.45
- CAS
- 16742-51-1
- 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 | 1.0106 | Relay (... Calculated Property | |
| ΔfG° | -280.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -874.28 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 43.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.68 | kJ/mol | Relay (... Calculated Property |
| IE | 10.05 | eV | Relay (... Calculated Property |
| log10WS | -4.64 | Relay (... Calculated Property | |
| logPoct/wat | 4.612 | Crippen Calculated Property | |
| McVol | 263.700 | ml/mol | McGowan Calculated Property |
| Pc | 1367.69 | kPa | Joback Calculated Property |
| Inp | [2046.80; 2048.00] |
|
|
| Inp | 2046.80 | NIST | |
| Inp | 2048.00 | NIST | |
| Inp | 2048.00 | NIST | |
| Inp | 2046.80 | NIST | |
| Tboil | 581.77 | K | Relay (... Calculated Property |
| Tc | 780.63 | K | Relay (... Calculated Property |
| Tfus | 332.82 | K | Relay (... Calculated Property |
| Vc | 1.018 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [808.17; 895.65] | J/mol×K | [756.39; 930.60] |
|
| Cp,gas | 808.17 | J/mol×K | 756.39 | Joback Calculated Property |
| Cp,gas | 824.72 | J/mol×K | 785.42 | Joback Calculated Property |
| Cp,gas | 840.45 | J/mol×K | 814.46 | Joback Calculated Property |
| Cp,gas | 855.40 | J/mol×K | 843.49 | Joback Calculated Property |
| Cp,gas | 869.56 | J/mol×K | 872.53 | Joback Calculated Property |
| Cp,gas | 882.98 | J/mol×K | 901.56 | Joback Calculated Property |
| Cp,gas | 895.65 | J/mol×K | 930.60 | Joback Calculated Property |
| η | [0.0000196; 0.0023196] | Pa×s | [399.33; 756.39] |
|
| η | 0.0023196 | Pa×s | 399.33 | Joback Calculated Property |
| η | 0.0006252 | Pa×s | 458.84 | Joback Calculated Property |
| η | 0.0002277 | Pa×s | 518.35 | Joback Calculated Property |
| η | 0.0001021 | Pa×s | 577.86 | Joback Calculated Property |
| η | 0.0000532 | Pa×s | 637.37 | Joback Calculated Property |
| η | 0.0000310 | Pa×s | 696.88 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 756.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecanoic acid, 2-hydroxy-, methyl ester.
Sources
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