- InChI
- InChI=1S/C20H28O4/c21-19(23-15-7-12-17-8-3-1-4-9-17)13-14-20(22)24-16-18-10-5-2-6-11-18/h1,3-4,8-9,18H,2,5-7,10-16H2
- InChI Key
- HDWCSQGQABBUTI-UHFFFAOYSA-N
- Formula
- C20H28O4
- SMILES
-
O=C(CCC(=O)OCC1CCCCC1)OCCCc1cc
ccc1 - Molecular Weight1
- 332.43
- 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° | -213.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.88 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.13 | kJ/mol | Joback Calculated Property |
| log10WS | -4.68 | Crippen Calculated Property | |
| logPoct/wat | 4.066 | Crippen Calculated Property | |
| McVol | 272.920 | ml/mol | McGowan Calculated Property |
| Pc | 1587.28 | kPa | Joback Calculated Property |
| Inp | [2623.00; 2623.00] |
|
|
| Inp | 2623.00 | NIST | |
| Inp | 2623.00 | NIST | |
| Tboil | 855.81 | K | Joback Calculated Property |
| Tc | 1074.27 | K | Joback Calculated Property |
| Tfus | 493.28 | K | Joback Calculated Property |
| Vc | 1.028 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [873.59; 954.71] | J/mol×K | [855.81; 1074.27] |
|
| Cp,gas | 873.59 | J/mol×K | 855.81 | Joback Calculated Property |
| Cp,gas | 890.67 | J/mol×K | 892.22 | Joback Calculated Property |
| Cp,gas | 906.28 | J/mol×K | 928.63 | Joback Calculated Property |
| Cp,gas | 920.45 | J/mol×K | 965.04 | Joback Calculated Property |
| Cp,gas | 933.22 | J/mol×K | 1001.45 | Joback Calculated Property |
| Cp,gas | 944.62 | J/mol×K | 1037.86 | Joback Calculated Property |
| Cp,gas | 954.71 | J/mol×K | 1074.27 | Joback Calculated Property |
| η | [0.0000560; 0.0007938] | Pa×s | [493.28; 855.81] |
|
| η | 0.0007938 | Pa×s | 493.28 | Joback Calculated Property |
| η | 0.0004009 | Pa×s | 553.70 | Joback Calculated Property |
| η | 0.0002316 | Pa×s | 614.12 | Joback Calculated Property |
| η | 0.0001476 | Pa×s | 674.54 | Joback Calculated Property |
| η | 0.0001013 | Pa×s | 734.97 | Joback Calculated Property |
| η | 0.0000736 | Pa×s | 795.39 | Joback Calculated Property |
| η | 0.0000560 | Pa×s | 855.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, cyclohexylmethyl 3-phenylpropyl ester.
Sources
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