- InChI
- InChI=1S/C19H28O4/c1-6-9-13-22-17(20)19(7-2,8-3)18(21)23-16-12-10-11-14(4)15(16)5/h10-12H,6-9,13H2,1-5H3
- InChI Key
- VPYRUNVYZZHYDN-UHFFFAOYSA-N
- Formula
- C19H28O4
- SMILES
-
CCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc
c(C)c1C - Molecular Weight1
- 320.42
- 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° | -262.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -720.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.50 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.359 | Crippen Calculated Property | |
| McVol | 269.690 | ml/mol | McGowan Calculated Property |
| Pc | 1445.73 | kPa | Joback Calculated Property |
| Inp | 2113.00 | NIST | |
| Tboil | 820.11 | K | Joback Calculated Property |
| Tc | 1026.51 | K | Joback Calculated Property |
| Tfus | 502.09 | K | Joback Calculated Property |
| Vc | 1.028 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [819.64; 899.65] | J/mol×K | [820.11; 1026.51] | 
|
| Cp,gas | 819.64 | J/mol×K | 820.11 | Joback Calculated Property |
| Cp,gas | 835.67 | J/mol×K | 854.51 | Joback Calculated Property |
| Cp,gas | 850.58 | J/mol×K | 888.91 | Joback Calculated Property |
| Cp,gas | 864.40 | J/mol×K | 923.31 | Joback Calculated Property |
| Cp,gas | 877.16 | J/mol×K | 957.71 | Joback Calculated Property |
| Cp,gas | 888.90 | J/mol×K | 992.11 | Joback Calculated Property |
| Cp,gas | 899.65 | J/mol×K | 1026.51 | Joback Calculated Property |
| η | [0.0000507; 0.0005170] | Pa×s | [502.09; 820.11] |
|
| η | 0.0005170 | Pa×s | 502.09 | Joback Calculated Property |
| η | 0.0002918 | Pa×s | 555.09 | Joback Calculated Property |
| η | 0.0001820 | Pa×s | 608.10 | Joback Calculated Property |
| η | 0.0001224 | Pa×s | 661.10 | Joback Calculated Property |
| η | 0.0000873 | Pa×s | 714.10 | Joback Calculated Property |
| η | 0.0000653 | Pa×s | 767.11 | Joback Calculated Property |
| η | 0.0000507 | Pa×s | 820.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, butyl 2,3-dimethylphenyl ester.
Sources
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