- InChI
- InChI=1S/C23H34O6/c1-4-5-6-7-10-16-28-22(24)17-12-8-9-13-18(17)23(25)29-21-19(26-2)14-11-15-20(21)27-3/h11,14-15,17-18H,4-10,12-13,16H2,1-3H3
- InChI Key
- NSZWUWWAYVQEPQ-UHFFFAOYSA-N
- Formula
- C23H34O6
- SMILES
-
CCCCCCCOC(=O)C1CCCCC1C(=O)Oc1c
(OC)cccc1OC - Molecular Weight1
- 406.51
- 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° | -425.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1024.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.64 | kJ/mol | Joback Calculated Property |
| log10WS | -5.74 | Crippen Calculated Property | |
| logPoct/wat | 4.929 | Crippen Calculated Property | |
| McVol | 326.930 | ml/mol | McGowan Calculated Property |
| Pc | 1193.17 | kPa | Joback Calculated Property |
| Inp | 2888.00 | NIST | |
| Tboil | 974.58 | K | Joback Calculated Property |
| Tc | 1197.08 | K | Joback Calculated Property |
| Tfus | 592.35 | K | Joback Calculated Property |
| Vc | 1.232 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1114.78; 1173.24] | J/mol×K | [974.58; 1197.08] | 
|
| Cp,gas | 1114.78 | J/mol×K | 974.58 | Joback Calculated Property |
| Cp,gas | 1129.50 | J/mol×K | 1011.66 | Joback Calculated Property |
| Cp,gas | 1142.25 | J/mol×K | 1048.75 | Joback Calculated Property |
| Cp,gas | 1153.00 | J/mol×K | 1085.83 | Joback Calculated Property |
| Cp,gas | 1161.75 | J/mol×K | 1122.91 | Joback Calculated Property |
| Cp,gas | 1168.50 | J/mol×K | 1159.99 | Joback Calculated Property |
| Cp,gas | 1173.24 | J/mol×K | 1197.08 | Joback Calculated Property |
| η | [0.0000275; 0.0002391] | Pa×s | [592.35; 974.58] |
|
| η | 0.0002391 | Pa×s | 592.35 | Joback Calculated Property |
| η | 0.0001400 | Pa×s | 656.05 | Joback Calculated Property |
| η | 0.0000901 | Pa×s | 719.76 | Joback Calculated Property |
| η | 0.0000623 | Pa×s | 783.46 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 847.17 | Joback Calculated Property |
| η | 0.0000348 | Pa×s | 910.88 | Joback Calculated Property |
| η | 0.0000275 | Pa×s | 974.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2,6-dimethoxyphenyl heptyl ester.
Sources
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