- InChI
- InChI=1S/C17H28O4/c1-11(2)12(3)20-16(18)5-4-6-17(19)21-15-10-13-7-8-14(15)9-13/h11-15H,4-10H2,1-3H3
- InChI Key
- DWKHCGDPOAMCKH-UHFFFAOYSA-N
- Formula
- C17H28O4
- SMILES
-
CC(C)C(C)OC(=O)CCCC(=O)OC1CC2C
CC1C2 - Molecular Weight1
- 296.40
- 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° | -278.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -775.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.66 | kJ/mol | Joback Calculated Property |
| log10WS | -3.95 | Crippen Calculated Property | |
| logPoct/wat | 3.476 | Crippen Calculated Property | |
| McVol | 243.550 | ml/mol | McGowan Calculated Property |
| Pc | 1612.88 | kPa | Joback Calculated Property |
| Inp | [2010.00; 2010.00] |
|
|
| Inp | 2010.00 | NIST | |
| Inp | 2010.00 | NIST | |
| Tboil | 753.14 | K | Joback Calculated Property |
| Tc | 953.65 | K | Joback Calculated Property |
| Tfus | 423.79 | K | Joback Calculated Property |
| Vc | 0.928 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [768.04; 863.37] | J/mol×K | [753.14; 953.65] |
|
| Cp,gas | 768.04 | J/mol×K | 753.14 | Joback Calculated Property |
| Cp,gas | 786.61 | J/mol×K | 786.56 | Joback Calculated Property |
| Cp,gas | 804.05 | J/mol×K | 819.98 | Joback Calculated Property |
| Cp,gas | 820.40 | J/mol×K | 853.39 | Joback Calculated Property |
| Cp,gas | 835.71 | J/mol×K | 886.81 | Joback Calculated Property |
| Cp,gas | 850.01 | J/mol×K | 920.23 | Joback Calculated Property |
| Cp,gas | 863.37 | J/mol×K | 953.65 | Joback Calculated Property |
| η | [0.0005001; 0.0027657] | Pa×s | [423.79; 753.14] |
|
| η | 0.0027657 | Pa×s | 423.79 | Joback Calculated Property |
| η | 0.0017662 | Pa×s | 478.68 | Joback Calculated Property |
| η | 0.0012369 | Pa×s | 533.57 | Joback Calculated Property |
| η | 0.0009258 | Pa×s | 588.47 | Joback Calculated Property |
| η | 0.0007280 | Pa×s | 643.36 | Joback Calculated Property |
| η | 0.0005946 | Pa×s | 698.25 | Joback Calculated Property |
| η | 0.0005001 | Pa×s | 753.14 | Joback Calculated Property |
Similar Compounds
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Sources
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