- InChI
- InChI=1S/C15H24O5/c1-4-5-6-7-8-11-19-14(17)9-10-15(18)20-13(3)12(2)16/h9-10,13H,4-8,11H2,1-3H3/b10-9+
- InChI Key
- LZRBSRFCMYHGGG-MDZDMXLPSA-N
- Formula
- C15H24O5
- SMILES
-
CCCCCCCOC(=O)C=CC(=O)OC(C)C(C)
=O - Molecular Weight1
- 284.35
- 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° | -443.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -843.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.61 | kJ/mol | Joback Calculated Property |
| log10WS | -3.07 | Crippen Calculated Property | |
| logPoct/wat | 2.577 | Crippen Calculated Property | |
| McVol | 234.360 | ml/mol | McGowan Calculated Property |
| Pc | 1675.53 | kPa | Joback Calculated Property |
| Inp | 1962.00 | NIST | |
| Tboil | 752.77 | K | Joback Calculated Property |
| Tc | 943.28 | K | Joback Calculated Property |
| Tfus | 432.98 | K | Joback Calculated Property |
| Vc | 0.903 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [675.61; 750.43] | J/mol×K | [752.77; 943.28] | 
|
| Cp,gas | 675.61 | J/mol×K | 752.77 | Joback Calculated Property |
| Cp,gas | 690.14 | J/mol×K | 784.52 | Joback Calculated Property |
| Cp,gas | 703.83 | J/mol×K | 816.27 | Joback Calculated Property |
| Cp,gas | 716.69 | J/mol×K | 848.02 | Joback Calculated Property |
| Cp,gas | 728.73 | J/mol×K | 879.77 | Joback Calculated Property |
| Cp,gas | 739.97 | J/mol×K | 911.53 | Joback Calculated Property |
| Cp,gas | 750.43 | J/mol×K | 943.28 | Joback Calculated Property |
| η | [0.0000820; 0.0011820] | Pa×s | [432.98; 752.77] |
|
| η | 0.0011820 | Pa×s | 432.98 | Joback Calculated Property |
| η | 0.0005938 | Pa×s | 486.28 | Joback Calculated Property |
| η | 0.0003417 | Pa×s | 539.58 | Joback Calculated Property |
| η | 0.0002172 | Pa×s | 592.88 | Joback Calculated Property |
| η | 0.0001488 | Pa×s | 646.17 | Joback Calculated Property |
| η | 0.0001080 | Pa×s | 699.47 | Joback Calculated Property |
| η | 0.0000820 | Pa×s | 752.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, heptyl 3-oxobut-2-yl ester.
Sources
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