- InChI
- InChI=1S/C28H52O6/c1-4-7-10-13-16-19-22-28(31)34-25(23-32-26(29)20-17-14-11-8-5-2)24-33-27(30)21-18-15-12-9-6-3/h25H,4-24H2,1-3H3
- InChI Key
- PVGJWYNUBYUGJV-UHFFFAOYSA-N
- Formula
- C28H52O6
- SMILES
-
CCCCCCCCC(=O)OC(COC(=O)CCCCCCC
)COC(=O)CCCCCCC - Molecular Weight1
- 484.71
- 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 | 1.3363 | Relay (1.0) Calculated Property | |
| ΔfG° | -519.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1534.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 73.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 135.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.456 | Crippen Calculated Property | |
| McVol | 427.700 | ml/mol | McGowan Calculated Property |
| Pc | 707.33 | kPa | Joback Calculated Property |
| Inp | [3042.60; 3042.60] |
|
|
| Inp | 3042.60 | NIST | |
| Inp | 3042.60 | NIST | |
| Tboil | 677.17 | K | Relay (1.0) Calculated Property |
| Tc | 837.92 | K | Relay (1.0) Calculated Property |
| Tfus | 298.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.642 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1521.90; 1598.43] | J/mol×K | [1068.47; 1339.10] |
|
| Cp,gas | 1521.90 | J/mol×K | 1068.47 | Joback Calculated Property |
| Cp,gas | 1541.33 | J/mol×K | 1113.58 | Joback Calculated Property |
| Cp,gas | 1557.99 | J/mol×K | 1158.68 | Joback Calculated Property |
| Cp,gas | 1571.96 | J/mol×K | 1203.79 | Joback Calculated Property |
| Cp,gas | 1583.31 | J/mol×K | 1248.89 | Joback Calculated Property |
| Cp,gas | 1592.11 | J/mol×K | 1294.00 | Joback Calculated Property |
| Cp,gas | 1598.43 | J/mol×K | 1339.10 | Joback Calculated Property |
| η | [0.0000097; 0.0001776] | Pa×s | [606.80; 1068.47] |
|
| η | 0.0001776 | Pa×s | 606.80 | Joback Calculated Property |
| η | 0.0000832 | Pa×s | 683.75 | Joback Calculated Property |
| η | 0.0000454 | Pa×s | 760.69 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 837.63 | Joback Calculated Property |
| η | 0.0000184 | Pa×s | 914.58 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 991.52 | Joback Calculated Property |
| η | 0.0000097 | Pa×s | 1068.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(Nonanoyloxy)propane-1,3-diyl dioctanoate.
Sources
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