- InChI
- InChI=1S/C28H38O4/c1-4-7-8-9-10-11-15-22-31-26(29)28(5-2,6-3)27(30)32-25-20-18-24(19-21-25)23-16-13-12-14-17-23/h12-14,16-21H,4-11,15,22H2,1-3H3
- InChI Key
- KWGOMGGWKJNEOR-UHFFFAOYSA-N
- Formula
- C28H38O4
- SMILES
-
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)O
c1ccc(-c2ccccc2)cc1 - Molecular Weight1
- 438.60
- 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 | 1.0563 | Relay (1.0) Calculated Property | |
| ΔfG° | -64.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -746.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 54.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 132.63 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.14 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.359 | Crippen Calculated Property | |
| McVol | 372.740 | ml/mol | McGowan Calculated Property |
| Pc | 1009.09 | kPa | Joback Calculated Property |
| Inp | 3210.00 | NIST | |
| Tboil | 716.32 | K | Relay (1.0) Calculated Property |
| Tc | 950.71 | K | Relay (1.0) Calculated Property |
| Tfus | 361.03 | K | Relay (1.0) Calculated Property |
| Vc | 1.343 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1260.72; 1332.59] | J/mol×K | [1047.73; 1283.24] | 
|
| Cp,gas | 1260.72 | J/mol×K | 1047.73 | Joback Calculated Property |
| Cp,gas | 1275.84 | J/mol×K | 1086.98 | Joback Calculated Property |
| Cp,gas | 1289.56 | J/mol×K | 1126.23 | Joback Calculated Property |
| Cp,gas | 1301.99 | J/mol×K | 1165.48 | Joback Calculated Property |
| Cp,gas | 1313.24 | J/mol×K | 1204.73 | Joback Calculated Property |
| Cp,gas | 1323.40 | J/mol×K | 1243.98 | Joback Calculated Property |
| Cp,gas | 1332.59 | J/mol×K | 1283.24 | Joback Calculated Property |
| η | [0.0000130; 0.0001784] | Pa×s | [617.42; 1047.73] |
|
| η | 0.0001784 | Pa×s | 617.42 | Joback Calculated Property |
| η | 0.0000918 | Pa×s | 689.14 | Joback Calculated Property |
| η | 0.0000536 | Pa×s | 760.86 | Joback Calculated Property |
| η | 0.0000343 | Pa×s | 832.58 | Joback Calculated Property |
| η | 0.0000236 | Pa×s | 904.29 | Joback Calculated Property |
| η | 0.0000171 | Pa×s | 976.01 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 1047.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-biphenyl nonyl ester.
Sources
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