- InChI
- InChI=1S/C19H26O4/c1-2-22-18(20)16-12-6-7-13-17(16)19(21)23-14-8-11-15-9-4-3-5-10-15/h3-5,9-10,16-17H,2,6-8,11-14H2,1H3
- InChI Key
- KWJDBMFJIKNDEI-UHFFFAOYSA-N
- Formula
- C19H26O4
- SMILES
-
CCOC(=O)C1CCCCC1C(=O)OCCCc1ccc
cc1 - Molecular Weight1
- 318.41
- 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° | -229.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.60 | kJ/mol | Joback Calculated Property |
| log10WS | -4.02 | Crippen Calculated Property | |
| logPoct/wat | 3.532 | Crippen Calculated Property | |
| McVol | 258.830 | ml/mol | McGowan Calculated Property |
| Pc | 1670.06 | kPa | Joback Calculated Property |
| Inp | 2361.00 | NIST | |
| Tboil | 828.26 | K | Joback Calculated Property |
| Tc | 1048.33 | K | Joback Calculated Property |
| Tfus | 477.77 | K | Joback Calculated Property |
| Vc | 0.972 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [818.42; 901.62] | J/mol×K | [828.26; 1048.33] | 
|
| Cp,gas | 818.42 | J/mol×K | 828.26 | Joback Calculated Property |
| Cp,gas | 835.98 | J/mol×K | 864.94 | Joback Calculated Property |
| Cp,gas | 852.03 | J/mol×K | 901.62 | Joback Calculated Property |
| Cp,gas | 866.59 | J/mol×K | 938.30 | Joback Calculated Property |
| Cp,gas | 879.69 | J/mol×K | 974.97 | Joback Calculated Property |
| Cp,gas | 891.36 | J/mol×K | 1011.65 | Joback Calculated Property |
| Cp,gas | 901.62 | J/mol×K | 1048.33 | Joback Calculated Property |
| η | [0.0000829; 0.0009434] | Pa×s | [477.77; 828.26] |
|
| η | 0.0009434 | Pa×s | 477.77 | Joback Calculated Property |
| η | 0.0005044 | Pa×s | 536.18 | Joback Calculated Property |
| η | 0.0003050 | Pa×s | 594.60 | Joback Calculated Property |
| η | 0.0002018 | Pa×s | 653.01 | Joback Calculated Property |
| η | 0.0001428 | Pa×s | 711.43 | Joback Calculated Property |
| η | 0.0001066 | Pa×s | 769.85 | Joback Calculated Property |
| η | 0.0000829 | Pa×s | 828.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl 3-phenylpropyl ester.
Sources
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