- InChI
- InChI=1S/C18H31ClO4/c1-2-3-4-5-6-9-13-22-17(20)15-10-7-8-11-16(15)18(21)23-14-12-19/h15-16H,2-14H2,1H3
- InChI Key
- TWWCWZSTVJDFMZ-UHFFFAOYSA-N
- Formula
- C18H31ClO4
- SMILES
-
CCCCCCCCOC(=O)C1CCCCC1C(=O)OCC
Cl - Molecular Weight1
- 346.89
- 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).
- 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° | -362.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -886.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.48 | kJ/mol | Joback Calculated Property |
| log10WS | -4.65 | Crippen Calculated Property | |
| logPoct/wat | 4.478 | Crippen Calculated Property | |
| McVol | 280.740 | ml/mol | McGowan Calculated Property |
| Pc | 1352.64 | kPa | Joback Calculated Property |
| Tboil | 816.13 | K | Joback Calculated Property |
| Tc | 1015.27 | K | Joback Calculated Property |
| Tfus | 470.00 | K | Joback Calculated Property |
| Vc | 1.073 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [880.38; 968.18] | J/mol×K | [816.13; 1015.27] | 
|
| Cp,gas | 880.38 | J/mol×K | 816.13 | Joback Calculated Property |
| Cp,gas | 898.13 | J/mol×K | 849.32 | Joback Calculated Property |
| Cp,gas | 914.61 | J/mol×K | 882.51 | Joback Calculated Property |
| Cp,gas | 929.85 | J/mol×K | 915.70 | Joback Calculated Property |
| Cp,gas | 943.84 | J/mol×K | 948.89 | Joback Calculated Property |
| Cp,gas | 956.62 | J/mol×K | 982.08 | Joback Calculated Property |
| Cp,gas | 968.18 | J/mol×K | 1015.27 | Joback Calculated Property |
| η | [0.0000810; 0.0010045] | Pa×s | [470.00; 816.13] |
|
| η | 0.0010045 | Pa×s | 470.00 | Joback Calculated Property |
| η | 0.0005250 | Pa×s | 527.69 | Joback Calculated Property |
| η | 0.0003118 | Pa×s | 585.38 | Joback Calculated Property |
| η | 0.0002033 | Pa×s | 643.07 | Joback Calculated Property |
| η | 0.0001423 | Pa×s | 700.75 | Joback Calculated Property |
| η | 0.0001051 | Pa×s | 758.44 | Joback Calculated Property |
| η | 0.0000810 | Pa×s | 816.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chloroethyl octyl ester.
Sources
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