- InChI
- InChI=1S/C25H44O4/c1-24(2,3)18-10-14-20(15-11-18)28-22(26)8-7-9-23(27)29-21-16-12-19(13-17-21)25(4,5)6/h18-21H,7-17H2,1-6H3
- InChI Key
- LLRPKUOCTIYRIM-UHFFFAOYSA-N
- Formula
- C25H44O4
- SMILES
-
CC(C)(C)C1CCC(OC(=O)CCCC(=O)OC
2CCC(C(C)(C)C)CC2)CC1 - Molecular Weight1
- 408.61
- 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° | -269.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -998.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.20 | kJ/mol | Joback Calculated Property |
| log10WS | -7.06 | Crippen Calculated Property | |
| logPoct/wat | 6.453 | Crippen Calculated Property | |
| McVol | 356.270 | ml/mol | McGowan Calculated Property |
| Pc | 1011.66 | kPa | Joback Calculated Property |
| Inp | [2872.00; 2872.00] |
|
|
| Inp | 2872.00 | NIST | |
| Inp | 2872.00 | NIST | |
| Tboil | 947.28 | K | Joback Calculated Property |
| Tc | 1171.20 | K | Joback Calculated Property |
| Tfus | 526.95 | K | Joback Calculated Property |
| Vc | 1.325 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1282.70; 1376.25] | J/mol×K | [947.28; 1171.20] |
|
| Cp,gas | 1282.70 | J/mol×K | 947.28 | Joback Calculated Property |
| Cp,gas | 1302.81 | J/mol×K | 984.60 | Joback Calculated Property |
| Cp,gas | 1321.00 | J/mol×K | 1021.92 | Joback Calculated Property |
| Cp,gas | 1337.36 | J/mol×K | 1059.24 | Joback Calculated Property |
| Cp,gas | 1351.96 | J/mol×K | 1096.56 | Joback Calculated Property |
| Cp,gas | 1364.90 | J/mol×K | 1133.88 | Joback Calculated Property |
| Cp,gas | 1376.25 | J/mol×K | 1171.20 | Joback Calculated Property |
| η | [0.0000275; 0.0005875] | Pa×s | [526.95; 947.28] |
|
| η | 0.0005875 | Pa×s | 526.95 | Joback Calculated Property |
| η | 0.0002615 | Pa×s | 597.00 | Joback Calculated Property |
| η | 0.0001380 | Pa×s | 667.06 | Joback Calculated Property |
| η | 0.0000822 | Pa×s | 737.12 | Joback Calculated Property |
| η | 0.0000536 | Pa×s | 807.17 | Joback Calculated Property |
| η | 0.0000374 | Pa×s | 877.23 | Joback Calculated Property |
| η | 0.0000275 | Pa×s | 947.28 | Joback Calculated Property |
Similar Compounds
Sources
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