- InChI
- InChI=1S/C20H34O6/c21-19(25-15-17-9-7-13-23-17)11-5-3-1-2-4-6-12-20(22)26-16-18-10-8-14-24-18/h17-18H,1-16H2
- InChI Key
- RHWOXBBBVFKHAN-UHFFFAOYSA-N
- Formula
- C20H34O6
- SMILES
-
O=C(CCCCCCCCC(=O)OCC1CCCO1)OCC
1CCCO1 - Molecular Weight1
- 370.48
- 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 | 0.9842 | Relay (1.0) Calculated Property | |
| ΔfG° | -449.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1230.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.20 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.552 | Crippen Calculated Property | |
| McVol | 297.560 | ml/mol | McGowan Calculated Property |
| Pc | 1367.69 | kPa | Joback Calculated Property |
| Inp | [2857.00; 2857.00] |
|
|
| Inp | 2857.00 | NIST | |
| Inp | 2857.00 | NIST | |
| Tboil | 671.75 | K | Relay (1.0) Calculated Property |
| Tc | 867.24 | K | Relay (1.0) Calculated Property |
| Tfus | 297.69 | K | Relay (1.0) Calculated Property |
| Vc | 1.166 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1023.35; 1107.14] | J/mol×K | [894.04; 1103.18] |
|
| Cp,gas | 1023.35 | J/mol×K | 894.04 | Joback Calculated Property |
| Cp,gas | 1040.73 | J/mol×K | 928.90 | Joback Calculated Property |
| Cp,gas | 1056.69 | J/mol×K | 963.75 | Joback Calculated Property |
| Cp,gas | 1071.27 | J/mol×K | 998.61 | Joback Calculated Property |
| Cp,gas | 1084.51 | J/mol×K | 1033.47 | Joback Calculated Property |
| Cp,gas | 1096.45 | J/mol×K | 1068.32 | Joback Calculated Property |
| Cp,gas | 1107.14 | J/mol×K | 1103.18 | Joback Calculated Property |
| η | [0.0000865; 0.0009657] | Pa×s | [534.42; 894.04] |
|
| η | 0.0009657 | Pa×s | 534.42 | Joback Calculated Property |
| η | 0.0005274 | Pa×s | 594.36 | Joback Calculated Property |
| η | 0.0003218 | Pa×s | 654.29 | Joback Calculated Property |
| η | 0.0002133 | Pa×s | 714.23 | Joback Calculated Property |
| η | 0.0001507 | Pa×s | 774.17 | Joback Calculated Property |
| η | 0.0001119 | Pa×s | 834.10 | Joback Calculated Property |
| η | 0.0000865 | Pa×s | 894.04 | Joback Calculated Property |
Similar Compounds
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Sources
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