- InChI
- InChI=1S/C18H34O4/c1-8-15(12(2)3)21-16(19)10-9-11-17(20)22-18(13(4)5)14(6)7/h12-15,18H,8-11H2,1-7H3
- InChI Key
- IYTSMQCIDJTVKH-UHFFFAOYSA-N
- Formula
- C18H34O4
- SMILES
-
CCC(OC(=O)CCCC(=O)OC(C(C)C)C(C
)C)C(C)C - Molecular Weight1
- 314.46
- 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 | 0.7988 | Relay (1.0) Calculated Property | |
| ΔfG° | -379.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1075.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.48 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.358 | Crippen Calculated Property | |
| McVol | 279.360 | ml/mol | McGowan Calculated Property |
| Pc | 1262.85 | kPa | Joback Calculated Property |
| Inp | [1860.00; 1860.00] |
|
|
| Inp | 1860.00 | NIST | |
| Inp | 1860.00 | NIST | |
| Tboil | 582.24 | K | Relay (1.0) Calculated Property |
| Tc | 743.71 | K | Relay (1.0) Calculated Property |
| Tfus | 246.69 | K | Relay (1.0) Calculated Property |
| Vc | 1.021 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [851.92; 945.95] | J/mol×K | [761.62; 948.22] |
|
| Cp,gas | 851.92 | J/mol×K | 761.62 | Joback Calculated Property |
| Cp,gas | 870.15 | J/mol×K | 792.72 | Joback Calculated Property |
| Cp,gas | 887.34 | J/mol×K | 823.82 | Joback Calculated Property |
| Cp,gas | 903.51 | J/mol×K | 854.92 | Joback Calculated Property |
| Cp,gas | 918.65 | J/mol×K | 886.02 | Joback Calculated Property |
| Cp,gas | 932.80 | J/mol×K | 917.12 | Joback Calculated Property |
| Cp,gas | 945.95 | J/mol×K | 948.22 | Joback Calculated Property |
| η | [0.0000468; 0.0032825] | Pa×s | [361.94; 761.62] |
|
| η | 0.0032825 | Pa×s | 361.94 | Joback Calculated Property |
| η | 0.0009323 | Pa×s | 428.55 | Joback Calculated Property |
| η | 0.0003715 | Pa×s | 495.17 | Joback Calculated Property |
| η | 0.0001841 | Pa×s | 561.78 | Joback Calculated Property |
| η | 0.0001059 | Pa×s | 628.39 | Joback Calculated Property |
| η | 0.0000677 | Pa×s | 695.01 | Joback Calculated Property |
| η | 0.0000468 | Pa×s | 761.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 2,4-dimethylpent-3-yl ester.
Sources
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