- InChI
- InChI=1S/C10H16O4/c1-5-13-9(11)8(7(3)4)10(12)14-6-2/h5-6H2,1-4H3
- InChI Key
- WEISAZNMMVPNTH-UHFFFAOYSA-N
- Formula
- C10H16O4
- SMILES
- CCOC(=O)C(C(=O)OCC)=C(C)C
- Molecular Weight1
- 200.23
- Other Names
-
- Malonic acid, isopropylidene-, diethyl ester
- Propanedioic acid, (1-methylethylidene)-, diethyl ester
- ω : Acentric Factor.
- 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).
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.6102 | Relay (1.0) Calculated Property | |
| ΔfG° | -371.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -758.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.34 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.449 | Crippen Calculated Property | |
| McVol | 162.340 | ml/mol | McGowan Calculated Property |
| Pc | 2441.06 | kPa | Joback Calculated Property |
| Tboil | 517.52 | K | Relay (1.0) Calculated Property |
| Tc | 683.93 | K | Relay (1.0) Calculated Property |
| Tfus | 245.88 | K | Relay (1.0) Calculated Property |
| Vc | 0.607 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [395.45; 464.83] | J/mol×K | [584.70; 777.91] | 
|
| Cp,gas | 395.45 | J/mol×K | 584.70 | Joback Calculated Property |
| Cp,gas | 408.51 | J/mol×K | 616.90 | Joback Calculated Property |
| Cp,gas | 420.96 | J/mol×K | 649.10 | Joback Calculated Property |
| Cp,gas | 432.81 | J/mol×K | 681.31 | Joback Calculated Property |
| Cp,gas | 444.07 | J/mol×K | 713.51 | Joback Calculated Property |
| Cp,gas | 454.74 | J/mol×K | 745.71 | Joback Calculated Property |
| Cp,gas | 464.83 | J/mol×K | 777.91 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 449.70 | K | 16.00 | NIST |
Similar Compounds
Find more compounds similar to Propanedioic acid, (1-methylethylidene)-, diethyl ester.
Sources
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