- InChI
- InChI=1S/C29H54O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-32-28(30)24-20-21-25-29(31)33-27(3)23-5-2/h5,27H,2,4,6-26H2,1,3H3
- InChI Key
- XROQBMOJVBWIML-UHFFFAOYSA-N
- Formula
- C29H54O4
- SMILES
-
C=CCC(C)OC(=O)CCCCC(=O)OCCCCCC
CCCCCCCCCCCC - Molecular Weight1
- 466.74
- 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 | 1.2771 | Relay (... Calculated Property | |
| ΔfG° | -189.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1163.09 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 71.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 128.12 | kJ/mol | Relay (... Calculated Property |
| IE | 9.66 | eV | Relay (... Calculated Property |
| log10WS | -7.51 | Relay (... Calculated Property | |
| logPoct/wat | 8.859 | Crippen Calculated Property | |
| McVol | 430.050 | ml/mol | McGowan Calculated Property |
| Pc | 671.16 | kPa | Joback Calculated Property |
| Inp | 3155.00 | NIST | |
| Tboil | 682.95 | K | Relay (... Calculated Property |
| Tc | 844.12 | K | Relay (... Calculated Property |
| Tfus | 295.19 | K | Relay (... Calculated Property |
| Vc | 1.631 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1509.38; 1615.38] | J/mol×K | [1011.74; 1257.87] | 
|
| Cp,gas | 1509.38 | J/mol×K | 1011.74 | Joback Calculated Property |
| Cp,gas | 1531.92 | J/mol×K | 1052.76 | Joback Calculated Property |
| Cp,gas | 1552.39 | J/mol×K | 1093.78 | Joback Calculated Property |
| Cp,gas | 1570.87 | J/mol×K | 1134.80 | Joback Calculated Property |
| Cp,gas | 1587.48 | J/mol×K | 1175.83 | Joback Calculated Property |
| Cp,gas | 1602.28 | J/mol×K | 1216.85 | Joback Calculated Property |
| Cp,gas | 1615.38 | J/mol×K | 1257.87 | Joback Calculated Property |
| η | [0.0000133; 0.0003203] | Pa×s | [544.15; 1011.74] |
|
| η | 0.0003203 | Pa×s | 544.15 | Joback Calculated Property |
| η | 0.0001351 | Pa×s | 622.08 | Joback Calculated Property |
| η | 0.0000690 | Pa×s | 700.01 | Joback Calculated Property |
| η | 0.0000404 | Pa×s | 777.94 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 855.88 | Joback Calculated Property |
| η | 0.0000181 | Pa×s | 933.81 | Joback Calculated Property |
| η | 0.0000133 | Pa×s | 1011.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, octadecyl pent-4-en-2-yl ester.
Sources
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