- InChI
- InChI=1S/C9H16O4/c1-5-12-7(10)9(3,4)8(11)13-6-2/h5-6H2,1-4H3
- InChI Key
- UELKSYXXNGHTSE-UHFFFAOYSA-N
- Formula
- C9H16O4
- SMILES
- CCOC(=O)C(C)(C)C(=O)OCC
- Molecular Weight1
- 188.22
- CAS
- 1619-62-1
- Other Names
-
- Diethyl dimethylmalonate
- Malonic acid, dimethyl-, 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 | 0.5262 | Relay (1.0) Calculated Property | |
| ΔfG° | -593.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -874.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.139 | Crippen Calculated Property | |
| McVol | 152.550 | ml/mol | McGowan Calculated Property |
| Pc | 2372.59 | kPa | Joback Calculated Property |
| Tboil | [465.20; 470.20] | K |
|
| Tboil | 465.20 | K | NIST |
| Tboil | 470.20 | K | NIST |
| Tc | 652.85 | K | Relay (1.0) Calculated Property |
| Tfus | 242.75 ± 0.50 | K | NIST |
| Vc | 0.582 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [361.81; 434.03] | J/mol×K | [518.73; 705.42] |
|
| Cp,gas | 361.81 | J/mol×K | 518.73 | Joback Calculated Property |
| Cp,gas | 375.56 | J/mol×K | 549.84 | Joback Calculated Property |
| Cp,gas | 388.61 | J/mol×K | 580.96 | Joback Calculated Property |
| Cp,gas | 400.97 | J/mol×K | 612.07 | Joback Calculated Property |
| Cp,gas | 412.66 | J/mol×K | 643.19 | Joback Calculated Property |
| Cp,gas | 423.67 | J/mol×K | 674.30 | Joback Calculated Property |
| Cp,gas | 434.03 | J/mol×K | 705.42 | Joback Calculated Property |
| η | [0.0001725; 0.0064936] | Pa×s | [278.27; 518.73] |
|
| η | 0.0064936 | Pa×s | 278.27 | Joback Calculated Property |
| η | 0.0024243 | Pa×s | 318.35 | Joback Calculated Property |
| η | 0.0011282 | Pa×s | 358.42 | Joback Calculated Property |
| η | 0.0006123 | Pa×s | 398.50 | Joback Calculated Property |
| η | 0.0003716 | Pa×s | 438.58 | Joback Calculated Property |
| η | 0.0002452 | Pa×s | 478.65 | Joback Calculated Property |
| η | 0.0001725 | Pa×s | 518.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanedioic acid, dimethyl-, diethyl ester.
Sources
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