- InChI
- InChI=1S/C15H22O3/c1-2-3-4-8-11-15(16)18-13-12-17-14-9-6-5-7-10-14/h5-7,9-10H,2-4,8,11-13H2,1H3
- InChI Key
- SYCCMBAXMWVEES-UHFFFAOYSA-N
- Formula
- C15H22O3
- SMILES
- CCCCCCC(=O)OCCOc1ccccc1
- Molecular Weight1
- 250.33
- 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° | -151.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -493.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.83 | kJ/mol | Joback Calculated Property |
| log10WS | -3.80 | Crippen Calculated Property | |
| logPoct/wat | 3.579 | Crippen Calculated Property | |
| McVol | 211.760 | ml/mol | McGowan Calculated Property |
| Pc | 1893.65 | kPa | Joback Calculated Property |
| Inp | 1816.00 | NIST | |
| Tboil | 667.99 | K | Joback Calculated Property |
| Tc | 864.11 | K | Joback Calculated Property |
| Tfus | 379.62 | K | Joback Calculated Property |
| Vc | 0.809 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [574.40; 659.52] | J/mol×K | [667.99; 864.11] | 
|
| Cp,gas | 574.40 | J/mol×K | 667.99 | Joback Calculated Property |
| Cp,gas | 590.82 | J/mol×K | 700.68 | Joback Calculated Property |
| Cp,gas | 606.32 | J/mol×K | 733.36 | Joback Calculated Property |
| Cp,gas | 620.93 | J/mol×K | 766.05 | Joback Calculated Property |
| Cp,gas | 634.65 | J/mol×K | 798.73 | Joback Calculated Property |
| Cp,gas | 647.51 | J/mol×K | 831.42 | Joback Calculated Property |
| Cp,gas | 659.52 | J/mol×K | 864.11 | Joback Calculated Property |
| η | [0.0001064; 0.0013698] | Pa×s | [379.62; 667.99] |
|
| η | 0.0013698 | Pa×s | 379.62 | Joback Calculated Property |
| η | 0.0007044 | Pa×s | 427.68 | Joback Calculated Property |
| η | 0.0004143 | Pa×s | 475.74 | Joback Calculated Property |
| η | 0.0002686 | Pa×s | 523.81 | Joback Calculated Property |
| η | 0.0001873 | Pa×s | 571.87 | Joback Calculated Property |
| η | 0.0001381 | Pa×s | 619.93 | Joback Calculated Property |
| η | 0.0001064 | Pa×s | 667.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Phenoxyethyl heptanoate.
Sources
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