- InChI
- InChI=1S/C23H28O4/c1-3-23(4-2,21(24)26-17-15-19-11-7-5-8-12-19)22(25)27-18-16-20-13-9-6-10-14-20/h5-14H,3-4,15-18H2,1-2H3
- InChI Key
- YWCMSYJIHQOLSO-UHFFFAOYSA-N
- Formula
- C23H28O4
- SMILES
-
CCC(CC)(C(=O)OCCc1ccccc1)C(=O)
OCCc1ccccc1 - Molecular Weight1
- 368.47
- 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).
- 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 | 0.8401 | Relay (1.0) Calculated Property | |
| ΔfG° | -97.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -610.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.55 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.365 | Crippen Calculated Property | |
| McVol | 302.290 | ml/mol | McGowan Calculated Property |
| Pc | 1420.78 | kPa | Joback Calculated Property |
| Inp | 2571.00 | NIST | |
| Tboil | 672.94 | K | Relay (1.0) Calculated Property |
| Tc | 912.40 | K | Relay (1.0) Calculated Property |
| Tfus | 327.36 | K | Relay (1.0) Calculated Property |
| Vc | 1.077 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [958.49; 1029.21] | J/mol×K | [928.35; 1154.94] | 
|
| Cp,gas | 958.49 | J/mol×K | 928.35 | Joback Calculated Property |
| Cp,gas | 973.24 | J/mol×K | 966.11 | Joback Calculated Property |
| Cp,gas | 986.70 | J/mol×K | 1003.88 | Joback Calculated Property |
| Cp,gas | 998.94 | J/mol×K | 1041.64 | Joback Calculated Property |
| Cp,gas | 1010.05 | J/mol×K | 1079.41 | Joback Calculated Property |
| Cp,gas | 1020.11 | J/mol×K | 1117.17 | Joback Calculated Property |
| Cp,gas | 1029.21 | J/mol×K | 1154.94 | Joback Calculated Property |
| η | [0.0000277; 0.0003826] | Pa×s | [548.55; 928.35] |
|
| η | 0.0003826 | Pa×s | 548.55 | Joback Calculated Property |
| η | 0.0001970 | Pa×s | 611.85 | Joback Calculated Property |
| η | 0.0001148 | Pa×s | 675.15 | Joback Calculated Property |
| η | 0.0000735 | Pa×s | 738.45 | Joback Calculated Property |
| η | 0.0000504 | Pa×s | 801.75 | Joback Calculated Property |
| η | 0.0000366 | Pa×s | 865.05 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 928.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, diphenethyl ester.
Sources
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