- InChI
- InChI=1S/C9H18O4/c1-4-11-8(10)7-9(12-5-2)13-6-3/h9H,4-7H2,1-3H3
- InChI Key
- SIALOQYKFQEKOG-UHFFFAOYSA-N
- Formula
- C9H18O4
- SMILES
- CCOC(=O)CC(OCC)OCC
- Molecular Weight1
- 190.24
- CAS
- 10601-80-6
- Other Names
-
- Propanoic acid, 3,3-diethoxy-, ethyl ester
- Ethyl 3,3-diethoxypropanoate
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.5630 | Relay (1.0) Calculated Property | |
| ΔfG° | -497.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -844.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.339 | Crippen Calculated Property | |
| McVol | 156.850 | ml/mol | McGowan Calculated Property |
| Pc | 2261.11 | kPa | Joback Calculated Property |
| Inp | 1163.00 | NIST | |
| Tboil | 460.03 | K | Relay (1.0) Calculated Property |
| Tc | 642.30 | K | Relay (1.0) Calculated Property |
| Tfus | 186.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.596 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [368.07; 441.88] | J/mol×K | [508.14; 681.35] | 
|
| Cp,gas | 368.07 | J/mol×K | 508.14 | Joback Calculated Property |
| Cp,gas | 381.52 | J/mol×K | 537.01 | Joback Calculated Property |
| Cp,gas | 394.52 | J/mol×K | 565.88 | Joback Calculated Property |
| Cp,gas | 407.07 | J/mol×K | 594.75 | Joback Calculated Property |
| Cp,gas | 419.15 | J/mol×K | 623.61 | Joback Calculated Property |
| Cp,gas | 430.76 | J/mol×K | 652.48 | Joback Calculated Property |
| Cp,gas | 441.88 | J/mol×K | 681.35 | Joback Calculated Property |
| η | [0.0001424; 0.0040846] | Pa×s | [262.98; 508.14] |
|
| η | 0.0040846 | Pa×s | 262.98 | Joback Calculated Property |
| η | 0.0016026 | Pa×s | 303.84 | Joback Calculated Property |
| η | 0.0007849 | Pa×s | 344.70 | Joback Calculated Property |
| η | 0.0004472 | Pa×s | 385.56 | Joback Calculated Property |
| η | 0.0002838 | Pa×s | 426.42 | Joback Calculated Property |
| η | 0.0001950 | Pa×s | 467.28 | Joback Calculated Property |
| η | 0.0001424 | Pa×s | 508.14 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 365.70 | K | 1.70 | NIST |
Similar Compounds
Find more compounds similar to Ethyl 3,3-diethoxypropionate.
Sources
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