- InChI
- InChI=1S/C19H34O4/c1-4-6-7-8-9-12-16-22-18(20)14-10-11-15-19(21)23-17(3)13-5-2/h5,17H,2,4,6-16H2,1,3H3
- InChI Key
- IOXXCUCRKDPOBB-UHFFFAOYSA-N
- Formula
- C19H34O4
- SMILES
-
C=CCC(C)OC(=O)CCCCC(=O)OCCCCCC
CC - Molecular Weight1
- 326.47
- 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 | 0.9244 | Relay (1.0) Calculated Property | |
| ΔfG° | -273.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -960.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.958 | Crippen Calculated Property | |
| McVol | 289.150 | ml/mol | McGowan Calculated Property |
| Pc | 1189.06 | kPa | Joback Calculated Property |
| Inp | 2148.00 | NIST | |
| Tboil | 609.57 | K | Relay (1.0) Calculated Property |
| Tc | 767.88 | K | Relay (1.0) Calculated Property |
| Tfus | 250.82 | K | Relay (1.0) Calculated Property |
| Vc | 1.080 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [883.01; 973.28] | J/mol×K | [782.94; 965.60] | 
|
| Cp,gas | 883.01 | J/mol×K | 782.94 | Joback Calculated Property |
| Cp,gas | 900.42 | J/mol×K | 813.38 | Joback Calculated Property |
| Cp,gas | 916.86 | J/mol×K | 843.83 | Joback Calculated Property |
| Cp,gas | 932.34 | J/mol×K | 874.27 | Joback Calculated Property |
| Cp,gas | 946.90 | J/mol×K | 904.71 | Joback Calculated Property |
| Cp,gas | 960.54 | J/mol×K | 935.16 | Joback Calculated Property |
| Cp,gas | 973.28 | J/mol×K | 965.60 | Joback Calculated Property |
| η | [0.0000602; 0.0011185] | Pa×s | [431.45; 782.94] |
|
| η | 0.0011185 | Pa×s | 431.45 | Joback Calculated Property |
| η | 0.0005136 | Pa×s | 490.03 | Joback Calculated Property |
| η | 0.0002785 | Pa×s | 548.61 | Joback Calculated Property |
| η | 0.0001700 | Pa×s | 607.20 | Joback Calculated Property |
| η | 0.0001131 | Pa×s | 665.78 | Joback Calculated Property |
| η | 0.0000804 | Pa×s | 724.36 | Joback Calculated Property |
| η | 0.0000602 | Pa×s | 782.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, octyl pent-4-en-2-yl ester.
Sources
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