- InChI
- InChI=1S/C13H20O4/c1-5-9-13(10-6-2,11(14)16-7-3)12(15)17-8-4/h5-6H,1-2,7-10H2,3-4H3
- InChI Key
- LYUUVYQGUMRKOV-UHFFFAOYSA-N
- Formula
- C13H20O4
- SMILES
- C=CCC(CC=C)(C(=O)OCC)C(=O)OCC
- Molecular Weight1
- 240.30
- CAS
- 3195-24-2
- Other Names
-
- Diallylmalonic acid diethyl ester
- Propanedioic acid, di-2-propenyl-, diethyl ester
- Malonic acid, diallyl-, diethyl ester
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -230.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -559.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.21 | kJ/mol | Joback Calculated Property |
| log10WS | -2.45 | Crippen Calculated Property | |
| logPoct/wat | 2.251 | Crippen Calculated Property | |
| McVol | 200.310 | ml/mol | McGowan Calculated Property |
| Pc | 1938.95 | kPa | Joback Calculated Property |
| Tboil | 639.55 | K | Joback Calculated Property |
| Tc | 829.50 | K | Joback Calculated Property |
| Tfus | 379.49 | K | Joback Calculated Property |
| Vc | 0.762 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [526.47; 602.28] | J/mol×K | [639.55; 829.50] | 
|
| Cp,gas | 526.47 | J/mol×K | 639.55 | Joback Calculated Property |
| Cp,gas | 541.01 | J/mol×K | 671.21 | Joback Calculated Property |
| Cp,gas | 554.75 | J/mol×K | 702.87 | Joback Calculated Property |
| Cp,gas | 567.73 | J/mol×K | 734.52 | Joback Calculated Property |
| Cp,gas | 579.96 | J/mol×K | 766.18 | Joback Calculated Property |
| Cp,gas | 591.47 | J/mol×K | 797.84 | Joback Calculated Property |
| Cp,gas | 602.28 | J/mol×K | 829.50 | Joback Calculated Property |
| η | [0.0001287; 0.0016514] | Pa×s | [379.49; 639.55] |
|
| η | 0.0016514 | Pa×s | 379.49 | Joback Calculated Property |
| η | 0.0008680 | Pa×s | 422.83 | Joback Calculated Property |
| η | 0.0005142 | Pa×s | 466.18 | Joback Calculated Property |
| η | 0.0003330 | Pa×s | 509.52 | Joback Calculated Property |
| η | 0.0002308 | Pa×s | 552.86 | Joback Calculated Property |
| η | 0.0001688 | Pa×s | 596.21 | Joback Calculated Property |
| η | 0.0001287 | Pa×s | 639.55 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 402.20 | K | 1.60 | NIST |
Similar Compounds
Find more compounds similar to Diethyl diallylmalonate.
Sources
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