- InChI
- InChI=1S/C25H31ClO4/c26-19-8-3-1-2-4-9-20-29-24(27)13-10-14-25(28)30-23-17-15-22(16-18-23)21-11-6-5-7-12-21/h5-7,11-12,15-18H,1-4,8-10,13-14,19-20H2
- InChI Key
- TZGPSJWHAVGYCI-UHFFFAOYSA-N
- Formula
- C25H31ClO4
- SMILES
-
O=C(CCCC(=O)Oc1ccc(-c2ccccc2)c
c1)OCCCCCCCCCl - Molecular Weight1
- 430.96
- 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° | -104.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -603.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.15 | kJ/mol | Joback Calculated Property |
| log10WS | -8.01 | Crippen Calculated Property | |
| logPoct/wat | 6.552 | Crippen Calculated Property | |
| McVol | 342.710 | ml/mol | McGowan Calculated Property |
| Pc | 1176.05 | kPa | Joback Calculated Property |
| Inp | [3496.00; 3496.00] |
|
|
| Inp | 3496.00 | NIST | |
| Inp | 3496.00 | NIST | |
| Tboil | 1019.75 | K | Joback Calculated Property |
| Tc | 1250.65 | K | Joback Calculated Property |
| Tfus | 611.11 | K | Joback Calculated Property |
| Vc | 1.317 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1099.67; 1158.98] | J/mol×K | [1019.75; 1250.65] |
|
| Cp,gas | 1099.67 | J/mol×K | 1019.75 | Joback Calculated Property |
| Cp,gas | 1112.87 | J/mol×K | 1058.23 | Joback Calculated Property |
| Cp,gas | 1124.65 | J/mol×K | 1096.72 | Joback Calculated Property |
| Cp,gas | 1135.09 | J/mol×K | 1135.20 | Joback Calculated Property |
| Cp,gas | 1144.25 | J/mol×K | 1173.68 | Joback Calculated Property |
| Cp,gas | 1152.19 | J/mol×K | 1212.16 | Joback Calculated Property |
| Cp,gas | 1158.98 | J/mol×K | 1250.65 | Joback Calculated Property |
| η | [0.0000231; 0.0002431] | Pa×s | [611.11; 1019.75] |
|
| η | 0.0002431 | Pa×s | 611.11 | Joback Calculated Property |
| η | 0.0001350 | Pa×s | 679.22 | Joback Calculated Property |
| η | 0.0000834 | Pa×s | 747.32 | Joback Calculated Property |
| η | 0.0000558 | Pa×s | 815.43 | Joback Calculated Property |
| η | 0.0000398 | Pa×s | 883.54 | Joback Calculated Property |
| η | 0.0000297 | Pa×s | 951.64 | Joback Calculated Property |
| η | 0.0000231 | Pa×s | 1019.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 8-chlorooctyl 4-biphenyl ester.
Sources
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