- InChI
- InChI=1S/C19H36O4/c1-6-7-8-9-10-11-12-13-14-22-17(20)19(4,5)18(21)23-15-16(2)3/h16H,6-15H2,1-5H3
- InChI Key
- DWAGQIVITBDMIY-UHFFFAOYSA-N
- Formula
- C19H36O4
- SMILES
-
CCCCCCCCCCOC(=O)C(C)(C)C(=O)OC
C(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 | 0.8898 | Relay (1.0) Calculated Property | |
| ΔfG° | -358.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1068.71 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.37 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.78 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.896 | Crippen Calculated Property | |
| McVol | 293.450 | ml/mol | McGowan Calculated Property |
| Pc | 1170.42 | kPa | Joback Calculated Property |
| Inp | [2001.00; 2001.00] |
|
|
| Inp | 2001.00 | NIST | |
| Inp | 2001.00 | NIST | |
| Tboil | 576.19 | K | Relay (1.0) Calculated Property |
| Tc | 761.63 | K | Relay (1.0) Calculated Property |
| Tfus | 264.08 | K | Relay (1.0) Calculated Property |
| Vc | 1.127 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [910.66; 1004.00] | J/mol×K | [783.03; 968.31] |
|
| Cp,gas | 910.66 | J/mol×K | 783.03 | Joback Calculated Property |
| Cp,gas | 928.69 | J/mol×K | 813.91 | Joback Calculated Property |
| Cp,gas | 945.69 | J/mol×K | 844.79 | Joback Calculated Property |
| Cp,gas | 961.70 | J/mol×K | 875.67 | Joback Calculated Property |
| Cp,gas | 976.73 | J/mol×K | 906.55 | Joback Calculated Property |
| Cp,gas | 990.82 | J/mol×K | 937.43 | Joback Calculated Property |
| Cp,gas | 1004.00 | J/mol×K | 968.31 | Joback Calculated Property |
| η | [0.0000457; 0.0010903] | Pa×s | [435.63; 783.03] |
|
| η | 0.0010903 | Pa×s | 435.63 | Joback Calculated Property |
| η | 0.0004713 | Pa×s | 493.53 | Joback Calculated Property |
| η | 0.0002430 | Pa×s | 551.43 | Joback Calculated Property |
| η | 0.0001421 | Pa×s | 609.33 | Joback Calculated Property |
| η | 0.0000912 | Pa×s | 667.23 | Joback Calculated Property |
| η | 0.0000628 | Pa×s | 725.13 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 783.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, decyl isobutyl ester.
Sources
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