- InChI
- InChI=1S/C19H36O4/c1-4-5-6-7-8-9-10-11-12-14-22-18(20)16-19(21)23-15-13-17(2)3/h17H,4-16H2,1-3H3
- InChI Key
- RGHMGEMEVJGTEK-UHFFFAOYSA-N
- Formula
- C19H36O4
- SMILES
-
CCCCCCCCCCCOC(=O)CC(=O)OCCC(C)
C - Molecular Weight1
- 328.49
- 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 | 0.9682 | Relay (1.0) Calculated Property | |
| ΔfG° | -514.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1067.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 50.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.25 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.040 | Crippen Calculated Property | |
| McVol | 293.450 | ml/mol | McGowan Calculated Property |
| Pc | 1093.54 | kPa | Joback Calculated Property |
| Inp | [2179.00; 2179.00] |
|
|
| Inp | 2179.00 | NIST | |
| Inp | 2179.00 | NIST | |
| Tboil | 601.41 | K | Relay (1.0) Calculated Property |
| Tc | 779.81 | K | Relay (1.0) Calculated Property |
| Tfus | 231.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.129 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [892.71; 986.99] | J/mol×K | [750.32; 926.21] |
|
| Cp,gas | 892.71 | J/mol×K | 750.32 | Joback Calculated Property |
| Cp,gas | 910.91 | J/mol×K | 779.63 | Joback Calculated Property |
| Cp,gas | 928.09 | J/mol×K | 808.95 | Joback Calculated Property |
| Cp,gas | 944.28 | J/mol×K | 838.26 | Joback Calculated Property |
| Cp,gas | 959.48 | J/mol×K | 867.58 | Joback Calculated Property |
| Cp,gas | 973.71 | J/mol×K | 896.89 | Joback Calculated Property |
| Cp,gas | 986.99 | J/mol×K | 926.21 | Joback Calculated Property |
| η | [0.0000450; 0.0022692] | Pa×s | [373.55; 750.32] |
|
| η | 0.0022692 | Pa×s | 373.55 | Joback Calculated Property |
| η | 0.0007377 | Pa×s | 436.35 | Joback Calculated Property |
| η | 0.0003182 | Pa×s | 499.14 | Joback Calculated Property |
| η | 0.0001656 | Pa×s | 561.93 | Joback Calculated Property |
| η | 0.0000983 | Pa×s | 624.73 | Joback Calculated Property |
| η | 0.0000642 | Pa×s | 687.52 | Joback Calculated Property |
| η | 0.0000450 | Pa×s | 750.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, undecyl 3-methylbutyl ester.
Sources
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