- InChI
- InChI=1S/C19H30O3/c1-2-3-4-5-6-7-8-12-15-19(20)22-17-16-21-18-13-10-9-11-14-18/h9-11,13-14H,2-8,12,15-17H2,1H3
- InChI Key
- YHLMXXACBOHIQC-UHFFFAOYSA-N
- Formula
- C19H30O3
- SMILES
- CCCCCCCCCCC(=O)OCCOc1ccccc1
- Molecular Weight1
- 306.44
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -117.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -575.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.73 | kJ/mol | Joback Calculated Property |
| log10WS | -5.48 | Crippen Calculated Property | |
| logPoct/wat | 5.139 | Crippen Calculated Property | |
| McVol | 268.120 | ml/mol | McGowan Calculated Property |
| Pc | 1390.22 | kPa | Joback Calculated Property |
| Inp | 2221.00 | NIST | |
| Tboil | 759.51 | K | Joback Calculated Property |
| Tc | 950.63 | K | Joback Calculated Property |
| Tfus | 424.70 | K | Joback Calculated Property |
| Vc | 1.034 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [798.38; 889.18] | J/mol×K | [759.51; 950.63] | 
|
| Cp,gas | 798.38 | J/mol×K | 759.51 | Joback Calculated Property |
| Cp,gas | 816.03 | J/mol×K | 791.36 | Joback Calculated Property |
| Cp,gas | 832.64 | J/mol×K | 823.22 | Joback Calculated Property |
| Cp,gas | 848.24 | J/mol×K | 855.07 | Joback Calculated Property |
| Cp,gas | 862.84 | J/mol×K | 886.92 | Joback Calculated Property |
| Cp,gas | 876.48 | J/mol×K | 918.77 | Joback Calculated Property |
| Cp,gas | 889.18 | J/mol×K | 950.63 | Joback Calculated Property |
| η | [0.0000644; 0.0009798] | Pa×s | [424.70; 759.51] |
|
| η | 0.0009798 | Pa×s | 424.70 | Joback Calculated Property |
| η | 0.0004782 | Pa×s | 480.50 | Joback Calculated Property |
| η | 0.0002710 | Pa×s | 536.30 | Joback Calculated Property |
| η | 0.0001709 | Pa×s | 592.11 | Joback Calculated Property |
| η | 0.0001167 | Pa×s | 647.91 | Joback Calculated Property |
| η | 0.0000846 | Pa×s | 703.71 | Joback Calculated Property |
| η | 0.0000644 | Pa×s | 759.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Phenoxyethyl undecanoate.
Sources
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