- InChI
- InChI=1S/C12H20O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h9-10H,3-8H2,1-2H3
- InChI Key
- ZTUZDYWYNQDJKR-UHFFFAOYSA-N
- Formula
- C12H20O4
- SMILES
- CCOC(=O)C1CCCCC1C(=O)OCC
- Molecular Weight1
- 228.28
- CAS
- 10138-59-7
- Other Names
-
- Cyclohexane-1,2-dicarboxylic acid, diethyl ester
- Diethyl cyclohexane-1,2-dicarboxylate
- Diethyl hexahydrophthalate
- Diethylester kyseliny hexahydrftalove
- Hexahydrophthalic acid diethyl ester
- 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).
- 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 | 0.5584 | Relay (1.0) Calculated Property | |
| ΔfG° | -553.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -847.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.919 | Crippen Calculated Property | |
| McVol | 183.960 | ml/mol | McGowan Calculated Property |
| Pc | 2088.84 | kPa | Joback Calculated Property |
| Tboil | 536.19 | K | Relay (1.0) Calculated Property |
| Tc | 746.55 | K | Relay (1.0) Calculated Property |
| Tfus | 291.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.662 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [496.34; 590.77] | J/mol×K | [605.48; 805.89] | 
|
| Cp,gas | 496.34 | J/mol×K | 605.48 | Joback Calculated Property |
| Cp,gas | 514.69 | J/mol×K | 638.88 | Joback Calculated Property |
| Cp,gas | 531.99 | J/mol×K | 672.28 | Joback Calculated Property |
| Cp,gas | 548.26 | J/mol×K | 705.68 | Joback Calculated Property |
| Cp,gas | 563.47 | J/mol×K | 739.08 | Joback Calculated Property |
| Cp,gas | 577.64 | J/mol×K | 772.49 | Joback Calculated Property |
| Cp,gas | 590.77 | J/mol×K | 805.89 | Joback Calculated Property |
| η | [0.0001558; 0.0039763] | Pa×s | [312.80; 605.48] |
|
| η | 0.0039763 | Pa×s | 312.80 | Joback Calculated Property |
| η | 0.0016099 | Pa×s | 361.58 | Joback Calculated Property |
| η | 0.0008082 | Pa×s | 410.36 | Joback Calculated Property |
| η | 0.0004697 | Pa×s | 459.14 | Joback Calculated Property |
| η | 0.0003029 | Pa×s | 507.92 | Joback Calculated Property |
| η | 0.0002110 | Pa×s | 556.70 | Joback Calculated Property |
| η | 0.0001558 | Pa×s | 605.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, diethyl ester.
Sources
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