- InChI
- InChI=1S/C19H32O5/c1-4-5-6-7-8-9-10-11-12-15-23-18(21)13-14-19(22)24-17(3)16(2)20/h13-14,17H,4-12,15H2,1-3H3/b14-13+
- InChI Key
- QQRTZCRDVYQBFJ-BUHFOSPRSA-N
- Formula
- C19H32O5
- SMILES
-
CCCCCCCCCCCOC(=O)C=CC(=O)OC(C)
C(C)=O - Molecular Weight1
- 340.45
- 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° | -409.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -925.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.75 | Crippen Calculated Property | |
| logPoct/wat | 4.137 | Crippen Calculated Property | |
| McVol | 290.720 | ml/mol | McGowan Calculated Property |
| Pc | 1251.26 | kPa | Joback Calculated Property |
| Inp | [2357.00; 2357.00] |
|
|
| Inp | 2357.00 | NIST | |
| Inp | 2357.00 | NIST | |
| Tboil | 844.29 | K | Joback Calculated Property |
| Tc | 1038.44 | K | Joback Calculated Property |
| Tfus | 478.06 | K | Joback Calculated Property |
| Vc | 1.127 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [905.95; 986.85] | J/mol×K | [844.29; 1038.44] |
|
| Cp,gas | 905.95 | J/mol×K | 844.29 | Joback Calculated Property |
| Cp,gas | 921.91 | J/mol×K | 876.65 | Joback Calculated Property |
| Cp,gas | 936.85 | J/mol×K | 909.01 | Joback Calculated Property |
| Cp,gas | 950.78 | J/mol×K | 941.37 | Joback Calculated Property |
| Cp,gas | 963.74 | J/mol×K | 973.72 | Joback Calculated Property |
| Cp,gas | 975.76 | J/mol×K | 1006.08 | Joback Calculated Property |
| Cp,gas | 986.85 | J/mol×K | 1038.44 | Joback Calculated Property |
| η | [0.0000468; 0.0007763] | Pa×s | [478.06; 844.29] |
|
| η | 0.0007763 | Pa×s | 478.06 | Joback Calculated Property |
| η | 0.0003729 | Pa×s | 539.10 | Joback Calculated Property |
| η | 0.0002079 | Pa×s | 600.14 | Joback Calculated Property |
| η | 0.0001291 | Pa×s | 661.17 | Joback Calculated Property |
| η | 0.0000869 | Pa×s | 722.21 | Joback Calculated Property |
| η | 0.0000622 | Pa×s | 783.25 | Joback Calculated Property |
| η | 0.0000468 | Pa×s | 844.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 3-oxobut-2-yl undecyl ester.
Sources
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