- InChI
- InChI=1S/C17H32O5/c1-8-11-20-14(18)17(9-2,10-3)15(19)22-13(4)12-21-16(5,6)7/h13H,8-12H2,1-7H3
- InChI Key
- KTTZEPZCXXYNEA-UHFFFAOYSA-N
- Formula
- C17H32O5
- SMILES
-
CCCOC(=O)C(CC)(CC)C(=O)OC(C)CO
C(C)(C)C - Molecular Weight1
- 316.43
- 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).
- Inp : Non-polar retention indices.
- 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° | -477.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1038.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.18 | kJ/mol | Joback Calculated Property |
| log10WS | -3.73 | Crippen Calculated Property | |
| logPoct/wat | 3.493 | Crippen Calculated Property | |
| McVol | 271.140 | ml/mol | McGowan Calculated Property |
| Pc | 1342.74 | kPa | Joback Calculated Property |
| Inp | [1727.00; 1727.00] |
|
|
| Inp | 1727.00 | NIST | |
| Inp | 1727.00 | NIST | |
| Tboil | 756.46 | K | Joback Calculated Property |
| Tc | 946.65 | K | Joback Calculated Property |
| Tfus | 437.74 | K | Joback Calculated Property |
| Vc | 1.026 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [825.38; 914.46] | J/mol×K | [756.46; 946.65] |
|
| Cp,gas | 825.38 | J/mol×K | 756.46 | Joback Calculated Property |
| Cp,gas | 842.73 | J/mol×K | 788.16 | Joback Calculated Property |
| Cp,gas | 859.04 | J/mol×K | 819.86 | Joback Calculated Property |
| Cp,gas | 874.34 | J/mol×K | 851.56 | Joback Calculated Property |
| Cp,gas | 888.66 | J/mol×K | 883.25 | Joback Calculated Property |
| Cp,gas | 902.02 | J/mol×K | 914.95 | Joback Calculated Property |
| Cp,gas | 914.46 | J/mol×K | 946.65 | Joback Calculated Property |
| η | [0.0000378; 0.0008966] | Pa×s | [437.74; 756.46] |
|
| η | 0.0008966 | Pa×s | 437.74 | Joback Calculated Property |
| η | 0.0003976 | Pa×s | 490.86 | Joback Calculated Property |
| η | 0.0002067 | Pa×s | 543.98 | Joback Calculated Property |
| η | 0.0001207 | Pa×s | 597.10 | Joback Calculated Property |
| η | 0.0000770 | Pa×s | 650.22 | Joback Calculated Property |
| η | 0.0000525 | Pa×s | 703.34 | Joback Calculated Property |
| η | 0.0000378 | Pa×s | 756.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, propyl 1-tert-butyloxyprop-2-yl ester.
Sources
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