- InChI
- InChI=1S/C20H28O5/c1-2-15-24-19(22)9-7-5-3-4-6-8-10-20(23)25-18-13-11-17(16-21)12-14-18/h11-14,16H,2-10,15H2,1H3
- InChI Key
- SDXQWJNKIYJMQA-UHFFFAOYSA-N
- Formula
- C20H28O5
- SMILES
-
CCCOC(=O)CCCCCCCCC(=O)Oc1ccc(C
=O)cc1 - Molecular Weight1
- 348.43
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.0466 | Relay (1.0) Calculated Property | |
| ΔfG° | -347.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -918.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.38 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.478 | Crippen Calculated Property | |
| McVol | 285.350 | ml/mol | McGowan Calculated Property |
| Pc | 1417.57 | kPa | Joback Calculated Property |
| Inp | [2793.00; 2793.00] |
|
|
| Inp | 2793.00 | NIST | |
| Inp | 2793.00 | NIST | |
| Tboil | 656.16 | K | Relay (1.0) Calculated Property |
| Tc | 871.71 | K | Relay (1.0) Calculated Property |
| Tfus | 331.84 | K | Relay (1.0) Calculated Property |
| Vc | 1.062 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [893.64; 962.54] | J/mol×K | [889.90; 1096.16] |
|
| Cp,gas | 893.64 | J/mol×K | 889.90 | Joback Calculated Property |
| Cp,gas | 907.95 | J/mol×K | 924.28 | Joback Calculated Property |
| Cp,gas | 921.09 | J/mol×K | 958.65 | Joback Calculated Property |
| Cp,gas | 933.10 | J/mol×K | 993.03 | Joback Calculated Property |
| Cp,gas | 944.00 | J/mol×K | 1027.40 | Joback Calculated Property |
| Cp,gas | 953.80 | J/mol×K | 1061.78 | Joback Calculated Property |
| Cp,gas | 962.54 | J/mol×K | 1096.16 | Joback Calculated Property |
| η | [0.0000590; 0.0005637] | Pa×s | [540.42; 889.90] |
|
| η | 0.0005637 | Pa×s | 540.42 | Joback Calculated Property |
| η | 0.0003223 | Pa×s | 598.67 | Joback Calculated Property |
| η | 0.0002035 | Pa×s | 656.91 | Joback Calculated Property |
| η | 0.0001385 | Pa×s | 715.16 | Joback Calculated Property |
| η | 0.0000998 | Pa×s | 773.41 | Joback Calculated Property |
| η | 0.0000754 | Pa×s | 831.65 | Joback Calculated Property |
| η | 0.0000590 | Pa×s | 889.90 | Joback Calculated Property |
Similar Compounds
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Sources
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