- InChI
- InChI=1S/C29H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-32-27(30)29(4,5)28(31)33-25-22-23-26(2)3/h26H,6-25H2,1-5H3
- InChI Key
- LTIMIGIYNQWUGY-UHFFFAOYSA-N
- Formula
- C29H56O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C
)C(=O)OCCCC(C)C - Molecular Weight1
- 468.75
- 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).
- 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 | 1.2354 | Relay (1.0) Calculated Property | |
| ΔfG° | -427.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1266.51 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 68.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.797 | Crippen Calculated Property | |
| McVol | 434.350 | ml/mol | McGowan Calculated Property |
| Pc | 636.08 | kPa | Joback Calculated Property |
| Tboil | 649.68 | K | Relay (1.0) Calculated Property |
| Tc | 843.97 | K | Relay (1.0) Calculated Property |
| Tfus | 289.47 | K | Relay (1.0) Calculated Property |
| Vc | 1.675 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1519.43; 1626.26] | J/mol×K | [975.89; 1205.50] | 
|
| Cp,gas | 1519.43 | J/mol×K | 975.89 | Joback Calculated Property |
| Cp,gas | 1541.70 | J/mol×K | 1014.16 | Joback Calculated Property |
| Cp,gas | 1562.05 | J/mol×K | 1052.43 | Joback Calculated Property |
| Cp,gas | 1580.59 | J/mol×K | 1090.70 | Joback Calculated Property |
| Cp,gas | 1597.40 | J/mol×K | 1128.96 | Joback Calculated Property |
| Cp,gas | 1612.59 | J/mol×K | 1167.23 | Joback Calculated Property |
| Cp,gas | 1626.26 | J/mol×K | 1205.50 | Joback Calculated Property |
| η | [0.0000070; 0.0004633] | Pa×s | [488.67; 975.89] |
|
| η | 0.0004633 | Pa×s | 488.67 | Joback Calculated Property |
| η | 0.0001402 | Pa×s | 569.87 | Joback Calculated Property |
| η | 0.0000572 | Pa×s | 651.08 | Joback Calculated Property |
| η | 0.0000284 | Pa×s | 732.28 | Joback Calculated Property |
| η | 0.0000163 | Pa×s | 813.48 | Joback Calculated Property |
| η | 0.0000103 | Pa×s | 894.69 | Joback Calculated Property |
| η | 0.0000070 | Pa×s | 975.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, isohexyl octadecyl ester.
Sources
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