- InChI
- InChI=1S/C24H26O4/c25-23(27-17-15-19-9-3-1-4-10-19)21-13-7-8-14-22(21)24(26)28-18-16-20-11-5-2-6-12-20/h1-12,21-22H,13-18H2
- InChI Key
- YCHDRXYELNNBCE-UHFFFAOYSA-N
- Formula
- C24H26O4
- SMILES
-
O=C(OCCc1ccccc1)C1CC=CCC1C(=O)
OCCc1ccccc1 - Molecular Weight1
- 378.46
- 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° | -45.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -463.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.29 | kJ/mol | Joback Calculated Property |
| log10WS | -5.07 | Crippen Calculated Property | |
| logPoct/wat | 4.141 | Crippen Calculated Property | |
| McVol | 301.220 | ml/mol | McGowan Calculated Property |
| Pc | 1525.88 | kPa | Joback Calculated Property |
| Inp | [2993.00; 2993.00] |
|
|
| Inp | 2993.00 | NIST | |
| Inp | 2993.00 | NIST | |
| Tboil | 968.50 | K | Joback Calculated Property |
| Tc | 1209.18 | K | Joback Calculated Property |
| Tfus | 561.30 | K | Joback Calculated Property |
| Vc | 1.129 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [984.74; 1044.31] | J/mol×K | [968.50; 1209.18] |
|
| Cp,gas | 984.74 | J/mol×K | 968.50 | Joback Calculated Property |
| Cp,gas | 998.80 | J/mol×K | 1008.61 | Joback Calculated Property |
| Cp,gas | 1011.11 | J/mol×K | 1048.73 | Joback Calculated Property |
| Cp,gas | 1021.75 | J/mol×K | 1088.84 | Joback Calculated Property |
| Cp,gas | 1030.78 | J/mol×K | 1128.95 | Joback Calculated Property |
| Cp,gas | 1038.27 | J/mol×K | 1169.07 | Joback Calculated Property |
| Cp,gas | 1044.31 | J/mol×K | 1209.18 | Joback Calculated Property |
| η | [0.0000467; 0.0004965] | Pa×s | [561.30; 968.50] |
|
| η | 0.0004965 | Pa×s | 561.30 | Joback Calculated Property |
| η | 0.0002708 | Pa×s | 629.17 | Joback Calculated Property |
| η | 0.0001662 | Pa×s | 697.03 | Joback Calculated Property |
| η | 0.0001112 | Pa×s | 764.90 | Joback Calculated Property |
| η | 0.0000795 | Pa×s | 832.77 | Joback Calculated Property |
| η | 0.0000598 | Pa×s | 900.63 | Joback Calculated Property |
| η | 0.0000467 | Pa×s | 968.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(phenethyl) ester.
Sources
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