- InChI
- InChI=1S/C23H34O5/c1-5-6-7-16-27-21(24)23(2,3)22(25)28-20-14-10-18(11-15-20)17-8-12-19(26-4)13-9-17/h8-9,12-13,18,20H,5-7,10-11,14-16H2,1-4H3
- InChI Key
- RONFBDJYLKNLSM-UHFFFAOYSA-N
- Formula
- C23H34O5
- SMILES
-
CCCCCOC(=O)C(C)(C)C(=O)OC1CCC(
c2ccc(OC)cc2)CC1 - Molecular Weight1
- 390.51
- 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° | -307.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -889.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.28 | kJ/mol | Joback Calculated Property |
| log10WS | -5.71 | Crippen Calculated Property | |
| logPoct/wat | 5.024 | Crippen Calculated Property | |
| McVol | 321.060 | ml/mol | McGowan Calculated Property |
| Pc | 1236.35 | kPa | Joback Calculated Property |
| Inp | 2910.00 | NIST | |
| Tboil | 943.95 | K | Joback Calculated Property |
| Tc | 1167.65 | K | Joback Calculated Property |
| Tfus | 560.02 | K | Joback Calculated Property |
| Vc | 1.202 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1087.22; 1159.93] | J/mol×K | [943.95; 1167.65] | 
|
| Cp,gas | 1087.22 | J/mol×K | 943.95 | Joback Calculated Property |
| Cp,gas | 1103.54 | J/mol×K | 981.23 | Joback Calculated Property |
| Cp,gas | 1118.12 | J/mol×K | 1018.52 | Joback Calculated Property |
| Cp,gas | 1131.01 | J/mol×K | 1055.80 | Joback Calculated Property |
| Cp,gas | 1142.25 | J/mol×K | 1093.09 | Joback Calculated Property |
| Cp,gas | 1151.87 | J/mol×K | 1130.37 | Joback Calculated Property |
| Cp,gas | 1159.93 | J/mol×K | 1167.65 | Joback Calculated Property |
| η | [0.0000277; 0.0003356] | Pa×s | [560.02; 943.95] |
|
| η | 0.0003356 | Pa×s | 560.02 | Joback Calculated Property |
| η | 0.0001790 | Pa×s | 624.01 | Joback Calculated Property |
| η | 0.0001073 | Pa×s | 688.00 | Joback Calculated Property |
| η | 0.0000702 | Pa×s | 751.98 | Joback Calculated Property |
| η | 0.0000490 | Pa×s | 815.97 | Joback Calculated Property |
| η | 0.0000361 | Pa×s | 879.96 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 943.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 4-(4-methoxyphenyl)cyclohexyl pentyl ester.
Sources
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