- InChI
- InChI=1S/C21H38O4/c1-6-10-12-18(8-3)15-24-20(22)14-17(5)21(23)25-16-19(9-4)13-11-7-2/h18-19H,5-16H2,1-4H3
- InChI Key
- CGNRQCGWXXLTIA-UHFFFAOYSA-N
- Formula
- C21H38O4
- SMILES
-
C=C(CC(=O)OCC(CC)CCCC)C(=O)OCC
(CC)CCCC - Molecular Weight1
- 354.52
- CAS
- 2287-83-4
- Other Names
-
- Butanedioic acid, 2-methylene, di(2-ethylhexyl) ester
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -267.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -861.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.29 | kJ/mol | Joback Calculated Property |
| log10WS | -5.71 | Crippen Calculated Property | |
| logPoct/wat | 5.452 | Crippen Calculated Property | |
| McVol | 317.330 | ml/mol | McGowan Calculated Property |
| Pc | 1054.83 | kPa | Joback Calculated Property |
| Tboil | 828.14 | K | Joback Calculated Property |
| Tc | 1017.35 | K | Joback Calculated Property |
| Tfus | 425.03 | K | Joback Calculated Property |
| Vc | 1.230 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1003.36; 1097.11] | J/mol×K | [828.14; 1017.35] | 
|
| Cp,gas | 1003.36 | J/mol×K | 828.14 | Joback Calculated Property |
| Cp,gas | 1021.68 | J/mol×K | 859.67 | Joback Calculated Property |
| Cp,gas | 1038.88 | J/mol×K | 891.21 | Joback Calculated Property |
| Cp,gas | 1055.01 | J/mol×K | 922.74 | Joback Calculated Property |
| Cp,gas | 1070.07 | J/mol×K | 954.28 | Joback Calculated Property |
| Cp,gas | 1084.09 | J/mol×K | 985.81 | Joback Calculated Property |
| Cp,gas | 1097.11 | J/mol×K | 1017.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bis(2-ethylhexyl) methylenesuccinate.
Sources
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