- InChI
- InChI=1S/C19H36O4/c1-6-9-10-12-16(7-2)22-18(20)13-11-14-19(21)23-17(8-3)15(4)5/h15-17H,6-14H2,1-5H3
- InChI Key
- YQDUYAGRVRZVRM-UHFFFAOYSA-N
- Formula
- C19H36O4
- SMILES
-
CCCCCC(CC)OC(=O)CCCC(=O)OC(CC)
C(C)C - Molecular Weight1
- 328.49
- 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 | 0.8898 | Relay (1.0) Calculated Property | |
| ΔfG° | -366.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1089.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.037 | Crippen Calculated Property | |
| McVol | 293.450 | ml/mol | McGowan Calculated Property |
| Pc | 1168.02 | kPa | Joback Calculated Property |
| Inp | [1975.00; 1975.00] |
|
|
| Inp | 1975.00 | NIST | |
| Inp | 1975.00 | NIST | |
| Tboil | 595.10 | K | Relay (1.0) Calculated Property |
| Tc | 758.61 | K | Relay (1.0) Calculated Property |
| Tfus | 232.17 | K | Relay (1.0) Calculated Property |
| Vc | 1.093 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [910.35; 1004.20] | J/mol×K | [785.38; 969.72] |
|
| Cp,gas | 910.35 | J/mol×K | 785.38 | Joback Calculated Property |
| Cp,gas | 928.54 | J/mol×K | 816.10 | Joback Calculated Property |
| Cp,gas | 945.69 | J/mol×K | 846.83 | Joback Calculated Property |
| Cp,gas | 961.82 | J/mol×K | 877.55 | Joback Calculated Property |
| Cp,gas | 976.93 | J/mol×K | 908.28 | Joback Calculated Property |
| Cp,gas | 991.06 | J/mol×K | 939.00 | Joback Calculated Property |
| Cp,gas | 1004.20 | J/mol×K | 969.72 | Joback Calculated Property |
| η | [0.0000478; 0.0016792] | Pa×s | [403.21; 785.38] |
|
| η | 0.0016792 | Pa×s | 403.21 | Joback Calculated Property |
| η | 0.0006190 | Pa×s | 466.90 | Joback Calculated Property |
| η | 0.0002900 | Pa×s | 530.60 | Joback Calculated Property |
| η | 0.0001598 | Pa×s | 594.29 | Joback Calculated Property |
| η | 0.0000989 | Pa×s | 657.99 | Joback Calculated Property |
| η | 0.0000666 | Pa×s | 721.68 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 785.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 3-octyl ester.
Sources
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