- InChI
- InChI=1S/C18H30O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3-4H,1-2,5-16H2
- InChI Key
- OJYNZEKRFKIIRG-UHFFFAOYSA-N
- Formula
- C18H30O4
- SMILES
- C=CCCOC(=O)CCCCCCCCC(=O)OCCC=C
- Molecular Weight1
- 310.43
- 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 | 0.9045 | Relay (1.0) Calculated Property | |
| ΔfG° | -191.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -840.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.346 | Crippen Calculated Property | |
| McVol | 270.760 | ml/mol | McGowan Calculated Property |
| Pc | 1303.29 | kPa | Joback Calculated Property |
| Inp | [2178.00; 2178.00] |
|
|
| Inp | 2178.00 | NIST | |
| Inp | 2178.00 | NIST | |
| Tboil | 619.18 | K | Relay (1.0) Calculated Property |
| Tc | 771.25 | K | Relay (1.0) Calculated Property |
| Tfus | 266.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.991 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [798.03; 883.39] | J/mol×K | [757.18; 937.96] |
|
| Cp,gas | 798.03 | J/mol×K | 757.18 | Joback Calculated Property |
| Cp,gas | 814.39 | J/mol×K | 787.31 | Joback Calculated Property |
| Cp,gas | 829.87 | J/mol×K | 817.44 | Joback Calculated Property |
| Cp,gas | 844.49 | J/mol×K | 847.57 | Joback Calculated Property |
| Cp,gas | 858.27 | J/mol×K | 877.70 | Joback Calculated Property |
| Cp,gas | 871.23 | J/mol×K | 907.83 | Joback Calculated Property |
| Cp,gas | 883.39 | J/mol×K | 937.96 | Joback Calculated Property |
| η | [0.0000797; 0.0010483] | Pa×s | [433.42; 757.18] |
|
| η | 0.0010483 | Pa×s | 433.42 | Joback Calculated Property |
| η | 0.0005380 | Pa×s | 487.38 | Joback Calculated Property |
| η | 0.0003154 | Pa×s | 541.34 | Joback Calculated Property |
| η | 0.0002037 | Pa×s | 595.30 | Joback Calculated Property |
| η | 0.0001414 | Pa×s | 649.26 | Joback Calculated Property |
| η | 0.0001039 | Pa×s | 703.22 | Joback Calculated Property |
| η | 0.0000797 | Pa×s | 757.18 | Joback Calculated Property |
Similar Compounds
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Sources
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