- InChI
- InChI=1S/C22H28O4/c1-4-7-10-16-25-20(23)22(5-2,6-3)21(24)26-19-15-11-13-17-12-8-9-14-18(17)19/h8-9,11-15H,4-7,10,16H2,1-3H3
- InChI Key
- HEHCRBYIGPISEZ-UHFFFAOYSA-N
- Formula
- C22H28O4
- SMILES
-
CCCCCOC(=O)C(CC)(CC)C(=O)Oc1cc
cc2ccccc12 - Molecular Weight1
- 356.46
- 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° | -121.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -579.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.16 | kJ/mol | Joback Calculated Property |
| log10WS | -6.40 | Crippen Calculated Property | |
| logPoct/wat | 5.285 | Crippen Calculated Property | |
| McVol | 292.500 | ml/mol | McGowan Calculated Property |
| Pc | 1415.44 | kPa | Joback Calculated Property |
| Inp | 2530.00 | NIST | |
| Tboil | 902.75 | K | Joback Calculated Property |
| Tc | 1121.90 | K | Joback Calculated Property |
| Tfus | 556.08 | K | Joback Calculated Property |
| Vc | 1.119 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [920.61; 996.61] | J/mol×K | [902.75; 1121.90] | 
|
| Cp,gas | 920.61 | J/mol×K | 902.75 | Joback Calculated Property |
| Cp,gas | 935.72 | J/mol×K | 939.27 | Joback Calculated Property |
| Cp,gas | 949.75 | J/mol×K | 975.80 | Joback Calculated Property |
| Cp,gas | 962.77 | J/mol×K | 1012.32 | Joback Calculated Property |
| Cp,gas | 974.87 | J/mol×K | 1048.85 | Joback Calculated Property |
| Cp,gas | 986.12 | J/mol×K | 1085.37 | Joback Calculated Property |
| Cp,gas | 996.61 | J/mol×K | 1121.90 | Joback Calculated Property |
| η | [0.0000645; 0.0005280] | Pa×s | [556.08; 902.75] |
|
| η | 0.0005280 | Pa×s | 556.08 | Joback Calculated Property |
| η | 0.0003154 | Pa×s | 613.86 | Joback Calculated Property |
| η | 0.0002059 | Pa×s | 671.64 | Joback Calculated Property |
| η | 0.0001438 | Pa×s | 729.41 | Joback Calculated Property |
| η | 0.0001059 | Pa×s | 787.19 | Joback Calculated Property |
| η | 0.0000813 | Pa×s | 844.97 | Joback Calculated Property |
| η | 0.0000645 | Pa×s | 902.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 1-naphthyl pentyl ester.
Sources
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