- InChI
- InChI=1S/C28H46O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-23-31-27(29)21-18-22-28(30)32-26-20-17-19-24(2)25(26)3/h17,19-20H,4-16,18,21-23H2,1-3H3
- InChI Key
- QEEZOURDZKKGMX-UHFFFAOYSA-N
- Formula
- C28H46O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCC(=O)O
c1cccc(C)c1C - Molecular Weight1
- 446.66
- 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 | 1.2594 | Relay (1.0) Calculated Property | |
| ΔfG° | -189.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1019.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 130.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.014 | Crippen Calculated Property | |
| McVol | 396.500 | ml/mol | McGowan Calculated Property |
| Pc | 810.30 | kPa | Joback Calculated Property |
| Inp | [3393.00; 3393.00] |
|
|
| Inp | 3393.00 | NIST | |
| Inp | 3393.00 | NIST | |
| Tboil | 692.27 | K | Relay (1.0) Calculated Property |
| Tc | 896.76 | K | Relay (1.0) Calculated Property |
| Tfus | 326.85 | K | Relay (1.0) Calculated Property |
| Vc | 1.499 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1368.97; 1451.15] | J/mol×K | [1029.26; 1265.35] |
|
| Cp,gas | 1368.97 | J/mol×K | 1029.26 | Joback Calculated Property |
| Cp,gas | 1387.04 | J/mol×K | 1068.61 | Joback Calculated Property |
| Cp,gas | 1403.28 | J/mol×K | 1107.96 | Joback Calculated Property |
| Cp,gas | 1417.75 | J/mol×K | 1147.31 | Joback Calculated Property |
| Cp,gas | 1430.51 | J/mol×K | 1186.65 | Joback Calculated Property |
| Cp,gas | 1441.62 | J/mol×K | 1226.00 | Joback Calculated Property |
| Cp,gas | 1451.15 | J/mol×K | 1265.35 | Joback Calculated Property |
| η | [0.0000172; 0.0002098] | Pa×s | [601.10; 1029.26] |
|
| η | 0.0002098 | Pa×s | 601.10 | Joback Calculated Property |
| η | 0.0001109 | Pa×s | 672.46 | Joback Calculated Property |
| η | 0.0000662 | Pa×s | 743.82 | Joback Calculated Property |
| η | 0.0000433 | Pa×s | 815.18 | Joback Calculated Property |
| η | 0.0000303 | Pa×s | 886.54 | Joback Calculated Property |
| η | 0.0000223 | Pa×s | 957.90 | Joback Calculated Property |
| η | 0.0000172 | Pa×s | 1029.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dimethylphenyl pentadecyl ester.
Sources
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