- InChI
- InChI=1S/C27H36O4/c1-18-12-9-14-20(26(3,4)5)24(18)30-22(28)16-11-17-23(29)31-25-19(2)13-10-15-21(25)27(6,7)8/h9-10,12-15H,11,16-17H2,1-8H3
- InChI Key
- YHRFTVXYANLGBC-UHFFFAOYSA-N
- Formula
- C27H36O4
- SMILES
-
Cc1cccc(C(C)(C)C)c1OC(=O)CCCC(
=O)Oc1c(C)cccc1C(C)(C)C - Molecular Weight1
- 424.57
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -99.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -680.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.62 | kJ/mol | Joback Calculated Property |
| log10WS | -7.75 | Crippen Calculated Property | |
| logPoct/wat | 6.580 | Crippen Calculated Property | |
| McVol | 358.650 | ml/mol | McGowan Calculated Property |
| Pc | 1055.51 | kPa | Joback Calculated Property |
| Inp | [3069.00; 3069.00] |
|
|
| Inp | 3069.00 | NIST | |
| Inp | 3069.00 | NIST | |
| Tboil | 1036.56 | K | Joback Calculated Property |
| Tc | 1273.76 | K | Joback Calculated Property |
| Tfus | 646.13 | K | Joback Calculated Property |
| Vc | 1.357 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1196.06; 1267.23] | J/mol×K | [1036.56; 1273.76] |
|
| Cp,gas | 1196.06 | J/mol×K | 1036.56 | Joback Calculated Property |
| Cp,gas | 1210.92 | J/mol×K | 1076.09 | Joback Calculated Property |
| Cp,gas | 1224.44 | J/mol×K | 1115.63 | Joback Calculated Property |
| Cp,gas | 1236.73 | J/mol×K | 1155.16 | Joback Calculated Property |
| Cp,gas | 1247.89 | J/mol×K | 1194.69 | Joback Calculated Property |
| Cp,gas | 1258.02 | J/mol×K | 1234.22 | Joback Calculated Property |
| Cp,gas | 1267.23 | J/mol×K | 1273.76 | Joback Calculated Property |
| η | [0.0000123; 0.0001219] | Pa×s | [646.13; 1036.56] |
|
| η | 0.0001219 | Pa×s | 646.13 | Joback Calculated Property |
| η | 0.0000699 | Pa×s | 711.20 | Joback Calculated Property |
| η | 0.0000440 | Pa×s | 776.27 | Joback Calculated Property |
| η | 0.0000297 | Pa×s | 841.35 | Joback Calculated Property |
| η | 0.0000212 | Pa×s | 906.42 | Joback Calculated Property |
| η | 0.0000159 | Pa×s | 971.49 | Joback Calculated Property |
| η | 0.0000123 | Pa×s | 1036.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, di(2-tert-butyl-6-methylphenyl) ester.
Sources
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