- InChI
- InChI=1S/C20H34O4/c1-3-5-7-8-9-10-11-12-13-14-18-24-20(22)16-15-19(21)23-17-6-4-2/h4,13-14H,2-3,5-12,15-18H2,1H3/b14-13+
- InChI Key
- AJSUOTAOMMWMPR-BUHFOSPRSA-N
- Formula
- C20H34O4
- SMILES
-
C=CCCOC(=O)CCC(=O)OCC=CCCCCCCC
CC - Molecular Weight1
- 338.48
- 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 | 0.9132 | Relay (... Calculated Property | |
| ΔfG° | -182.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -897.25 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 52.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.49 | kJ/mol | Relay (... Calculated Property |
| IE | 9.15 | eV | Relay (... Calculated Property |
| log10WS | -5.22 | Relay (... Calculated Property | |
| logPoct/wat | 5.126 | Crippen Calculated Property | |
| McVol | 298.940 | ml/mol | McGowan Calculated Property |
| Pc | 1147.54 | kPa | Joback Calculated Property |
| Inp | [2366.00; 2366.00] |
|
|
| Inp | 2366.00 | NIST | |
| Inp | 2366.00 | NIST | |
| Tboil | 630.16 | K | Relay (... Calculated Property |
| Tc | 788.59 | K | Relay (... Calculated Property |
| Tfus | 253.24 | K | Relay (... Calculated Property |
| Vc | 1.089 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [916.92; 1005.94] | J/mol×K | [810.42; 997.04] |
|
| Cp,gas | 916.92 | J/mol×K | 810.42 | Joback Calculated Property |
| Cp,gas | 934.06 | J/mol×K | 841.52 | Joback Calculated Property |
| Cp,gas | 950.25 | J/mol×K | 872.63 | Joback Calculated Property |
| Cp,gas | 965.49 | J/mol×K | 903.73 | Joback Calculated Property |
| Cp,gas | 979.84 | J/mol×K | 934.83 | Joback Calculated Property |
| Cp,gas | 993.31 | J/mol×K | 965.94 | Joback Calculated Property |
| Cp,gas | 1005.94 | J/mol×K | 997.04 | Joback Calculated Property |
| η | [0.0000494; 0.0007901] | Pa×s | [452.64; 810.42] |
|
| η | 0.0007901 | Pa×s | 452.64 | Joback Calculated Property |
| η | 0.0003805 | Pa×s | 512.27 | Joback Calculated Property |
| η | 0.0002134 | Pa×s | 571.90 | Joback Calculated Property |
| η | 0.0001335 | Pa×s | 631.53 | Joback Calculated Property |
| η | 0.0000905 | Pa×s | 691.16 | Joback Calculated Property |
| η | 0.0000653 | Pa×s | 750.79 | Joback Calculated Property |
| η | 0.0000494 | Pa×s | 810.42 | Joback Calculated Property |
Similar Compounds
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Sources
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