- InChI
- InChI=1S/C19H32O4/c1-5-17(14(2)3)23-19(21)12-8-11-18(20)22-13-16-10-7-6-9-15(16)4/h14,17H,5-13H2,1-4H3
- InChI Key
- DTOFYLQVDMAUSC-UHFFFAOYSA-N
- Formula
- C19H32O4
- SMILES
-
CCC(OC(=O)CCCC(=O)OCC1=C(C)CCC
C1)C(C)C - Molecular Weight1
- 324.45
- 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° | -320.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -826.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.78 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.568 | Crippen Calculated Property | |
| McVol | 278.290 | ml/mol | McGowan Calculated Property |
| Pc | 1381.96 | kPa | Joback Calculated Property |
| Inp | 2174.00 | NIST | |
| Tboil | 819.16 | K | Joback Calculated Property |
| Tc | 1021.06 | K | Joback Calculated Property |
| Tfus | 455.63 | K | Joback Calculated Property |
| Vc | 1.056 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [875.45; 963.94] | J/mol×K | [819.16; 1021.06] | 
|
| Cp,gas | 875.45 | J/mol×K | 819.16 | Joback Calculated Property |
| Cp,gas | 893.23 | J/mol×K | 852.81 | Joback Calculated Property |
| Cp,gas | 909.77 | J/mol×K | 886.46 | Joback Calculated Property |
| Cp,gas | 925.10 | J/mol×K | 920.11 | Joback Calculated Property |
| Cp,gas | 939.22 | J/mol×K | 953.76 | Joback Calculated Property |
| Cp,gas | 952.16 | J/mol×K | 987.41 | Joback Calculated Property |
| Cp,gas | 963.94 | J/mol×K | 1021.06 | Joback Calculated Property |
| η | [0.0000458; 0.0009255] | Pa×s | [455.63; 819.16] |
|
| η | 0.0009255 | Pa×s | 455.63 | Joback Calculated Property |
| η | 0.0004180 | Pa×s | 516.22 | Joback Calculated Property |
| η | 0.0002231 | Pa×s | 576.81 | Joback Calculated Property |
| η | 0.0001342 | Pa×s | 637.39 | Joback Calculated Property |
| η | 0.0000882 | Pa×s | 697.98 | Joback Calculated Property |
| η | 0.0000619 | Pa×s | 758.57 | Joback Calculated Property |
| η | 0.0000458 | Pa×s | 819.16 | Joback Calculated Property |
Similar Compounds
Sources
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