- InChI
- InChI=1S/C18H30O4/c1-13(2)15(4)22-18(20)11-7-10-17(19)21-12-16-9-6-5-8-14(16)3/h13,15H,5-12H2,1-4H3
- InChI Key
- CAKDGMSLMYFZON-UHFFFAOYSA-N
- Formula
- C18H30O4
- SMILES
-
CC1=C(COC(=O)CCCC(=O)OC(C)C(C)
C)CCCC1 - Molecular Weight1
- 310.43
- 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° | -329.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -805.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.55 | kJ/mol | Joback Calculated Property |
| log10WS | -4.70 | Crippen Calculated Property | |
| logPoct/wat | 4.178 | Crippen Calculated Property | |
| McVol | 264.200 | ml/mol | McGowan Calculated Property |
| Pc | 1486.14 | kPa | Joback Calculated Property |
| Inp | [2095.00; 2095.00] |
|
|
| Inp | 2095.00 | NIST | |
| Inp | 2095.00 | NIST | |
| Tboil | 796.28 | K | Joback Calculated Property |
| Tc | 998.66 | K | Joback Calculated Property |
| Tfus | 444.36 | K | Joback Calculated Property |
| Vc | 1.000 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [816.39; 904.67] | J/mol×K | [796.28; 998.66] |
|
| Cp,gas | 816.39 | J/mol×K | 796.28 | Joback Calculated Property |
| Cp,gas | 834.05 | J/mol×K | 830.01 | Joback Calculated Property |
| Cp,gas | 850.50 | J/mol×K | 863.74 | Joback Calculated Property |
| Cp,gas | 865.78 | J/mol×K | 897.47 | Joback Calculated Property |
| Cp,gas | 879.89 | J/mol×K | 931.20 | Joback Calculated Property |
| Cp,gas | 892.85 | J/mol×K | 964.93 | Joback Calculated Property |
| Cp,gas | 904.67 | J/mol×K | 998.66 | Joback Calculated Property |
| η | [0.0000530; 0.0010379] | Pa×s | [444.36; 796.28] |
|
| η | 0.0010379 | Pa×s | 444.36 | Joback Calculated Property |
| η | 0.0004734 | Pa×s | 503.01 | Joback Calculated Property |
| η | 0.0002544 | Pa×s | 561.67 | Joback Calculated Property |
| η | 0.0001538 | Pa×s | 620.32 | Joback Calculated Property |
| η | 0.0001014 | Pa×s | 678.97 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 737.63 | Joback Calculated Property |
| η | 0.0000530 | Pa×s | 796.28 | Joback Calculated Property |
Similar Compounds
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Sources
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