- InChI
- InChI=1S/C17H26O3/c1-4-6-10-15(5-2)13-19-17(18)14(3)20-16-11-8-7-9-12-16/h7-9,11-12,14-15H,4-6,10,13H2,1-3H3
- InChI Key
- KKSYEZLSHKWXEN-UHFFFAOYSA-N
- Formula
- C17H26O3
- SMILES
- CCCCC(CC)COC(=O)C(C)Oc1ccccc1
- Molecular Weight1
- 278.39
- 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° | -139.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -545.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.50 | kJ/mol | Joback Calculated Property |
| log10WS | -4.51 | Crippen Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 239.940 | ml/mol | McGowan Calculated Property |
| Pc | 1633.81 | kPa | Joback Calculated Property |
| Inp | 1803.00 | NIST | |
| Tboil | 712.87 | K | Joback Calculated Property |
| Tc | 911.35 | K | Joback Calculated Property |
| Tfus | 372.16 | K | Joback Calculated Property |
| Vc | 0.909 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [685.13; 775.76] | J/mol×K | [712.87; 911.35] | 
|
| Cp,gas | 685.13 | J/mol×K | 712.87 | Joback Calculated Property |
| Cp,gas | 702.79 | J/mol×K | 745.95 | Joback Calculated Property |
| Cp,gas | 719.41 | J/mol×K | 779.03 | Joback Calculated Property |
| Cp,gas | 734.99 | J/mol×K | 812.11 | Joback Calculated Property |
| Cp,gas | 749.56 | J/mol×K | 845.19 | Joback Calculated Property |
| Cp,gas | 763.14 | J/mol×K | 878.27 | Joback Calculated Property |
| Cp,gas | 775.76 | J/mol×K | 911.35 | Joback Calculated Property |
| η | [0.0000713; 0.0017910] | Pa×s | [372.16; 712.87] |
|
| η | 0.0017910 | Pa×s | 372.16 | Joback Calculated Property |
| η | 0.0007332 | Pa×s | 428.94 | Joback Calculated Property |
| η | 0.0003699 | Pa×s | 485.73 | Joback Calculated Property |
| η | 0.0002153 | Pa×s | 542.51 | Joback Calculated Property |
| η | 0.0001389 | Pa×s | 599.30 | Joback Calculated Property |
| η | 0.0000967 | Pa×s | 656.09 | Joback Calculated Property |
| η | 0.0000713 | Pa×s | 712.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Ethylhexyl 2-phenoxypropionate.
Sources
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