- InChI
- InChI=1S/C19H28O4/c1-4-17(15(2)3)23-19(21)13-12-18(20)22-14-8-11-16-9-6-5-7-10-16/h5-7,9-10,15,17H,4,8,11-14H2,1-3H3
- InChI Key
- JXXRZJVYNRCMMC-UHFFFAOYSA-N
- Formula
- C19H28O4
- SMILES
-
CCC(OC(=O)CCC(=O)OCCCc1ccccc1)
C(C)C - Molecular Weight1
- 320.42
- 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° | -251.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -699.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.70 | kJ/mol | Joback Calculated Property |
| log10WS | -4.47 | Crippen Calculated Property | |
| logPoct/wat | 3.920 | Crippen Calculated Property | |
| McVol | 269.690 | ml/mol | McGowan Calculated Property |
| Pc | 1475.88 | kPa | Joback Calculated Property |
| Inp | [2272.00; 2272.00] |
|
|
| Inp | 2272.00 | NIST | |
| Inp | 2272.00 | NIST | |
| Tboil | 812.50 | K | Joback Calculated Property |
| Tc | 1015.45 | K | Joback Calculated Property |
| Tfus | 444.63 | K | Joback Calculated Property |
| Vc | 1.028 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [820.77; 901.96] | J/mol×K | [812.50; 1015.45] |
|
| Cp,gas | 820.77 | J/mol×K | 812.50 | Joback Calculated Property |
| Cp,gas | 837.10 | J/mol×K | 846.32 | Joback Calculated Property |
| Cp,gas | 852.27 | J/mol×K | 880.15 | Joback Calculated Property |
| Cp,gas | 866.32 | J/mol×K | 913.97 | Joback Calculated Property |
| Cp,gas | 879.27 | J/mol×K | 947.80 | Joback Calculated Property |
| Cp,gas | 891.14 | J/mol×K | 981.62 | Joback Calculated Property |
| Cp,gas | 901.96 | J/mol×K | 1015.45 | Joback Calculated Property |
| η | [0.0000525; 0.0010535] | Pa×s | [444.63; 812.50] |
|
| η | 0.0010535 | Pa×s | 444.63 | Joback Calculated Property |
| η | 0.0004721 | Pa×s | 505.94 | Joback Calculated Property |
| η | 0.0002516 | Pa×s | 567.25 | Joback Calculated Property |
| η | 0.0001517 | Pa×s | 628.57 | Joback Calculated Property |
| η | 0.0001000 | Pa×s | 689.88 | Joback Calculated Property |
| η | 0.0000706 | Pa×s | 751.19 | Joback Calculated Property |
| η | 0.0000525 | Pa×s | 812.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-methylpent-3-yl 3-phenylpropyl ester.
Sources
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