- InChI
- InChI=1S/C17H24O4/c1-12(2)11-20-16(18)9-6-10-17(19)21-15-8-5-7-13(3)14(15)4/h5,7-8,12H,6,9-11H2,1-4H3
- InChI Key
- RXVRMZLCIUESRK-UHFFFAOYSA-N
- Formula
- C17H24O4
- SMILES
-
Cc1cccc(OC(=O)CCCC(=O)OCC(C)C)
c1C - Molecular Weight1
- 292.37
- 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 | 0.8215 | Relay (... Calculated Property | |
| ΔfG° | -284.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -808.00 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 35.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.18 | kJ/mol | Relay (... Calculated Property |
| IE | 8.28 | eV | Relay (... Calculated Property |
| log10WS | -3.90 | Relay (... Calculated Property | |
| logPoct/wat | 3.578 | Crippen Calculated Property | |
| McVol | 241.510 | ml/mol | McGowan Calculated Property |
| Pc | 1667.33 | kPa | Joback Calculated Property |
| Inp | 2177.00 | NIST | |
| Tboil | 614.47 | K | Relay (... Calculated Property |
| Tc | 811.72 | K | Relay (... Calculated Property |
| Tfus | 312.45 | K | Relay (... Calculated Property |
| Vc | 0.897 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [704.13; 781.95] | J/mol×K | [777.14; 981.04] | 
|
| Cp,gas | 704.13 | J/mol×K | 777.14 | Joback Calculated Property |
| Cp,gas | 719.66 | J/mol×K | 811.12 | Joback Calculated Property |
| Cp,gas | 734.15 | J/mol×K | 845.11 | Joback Calculated Property |
| Cp,gas | 747.62 | J/mol×K | 879.09 | Joback Calculated Property |
| Cp,gas | 760.06 | J/mol×K | 913.08 | Joback Calculated Property |
| Cp,gas | 771.51 | J/mol×K | 947.06 | Joback Calculated Property |
| Cp,gas | 781.95 | J/mol×K | 981.04 | Joback Calculated Property |
| η | [0.0000760; 0.0007546] | Pa×s | [462.13; 777.14] |
|
| η | 0.0007546 | Pa×s | 462.13 | Joback Calculated Property |
| η | 0.0004235 | Pa×s | 514.63 | Joback Calculated Property |
| η | 0.0002645 | Pa×s | 567.13 | Joback Calculated Property |
| η | 0.0001789 | Pa×s | 619.63 | Joback Calculated Property |
| η | 0.0001287 | Pa×s | 672.14 | Joback Calculated Property |
| η | 0.0000971 | Pa×s | 724.64 | Joback Calculated Property |
| η | 0.0000760 | Pa×s | 777.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dimethylphenyl isobutyl ester.
Sources
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