- InChI
- InChI=1S/C26H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29-25(27)22-26(28)30-24(4)21-23(2)3/h23-24H,5-22H2,1-4H3
- InChI Key
- SYGIOFGABPXDRU-UHFFFAOYSA-N
- Formula
- C26H50O4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CC(=O)O
C(C)CC(C)C - Molecular Weight1
- 426.67
- 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 | 1.1751 | Relay (1.0) Calculated Property | |
| ΔfG° | -304.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1225.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.28 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.769 | Crippen Calculated Property | |
| McVol | 392.080 | ml/mol | McGowan Calculated Property |
| Pc | 769.04 | kPa | Joback Calculated Property |
| Inp | [2772.00; 2772.00] |
|
|
| Inp | 2772.00 | NIST | |
| Inp | 2772.00 | NIST | |
| Tboil | 638.32 | K | Relay (1.0) Calculated Property |
| Tc | 824.79 | K | Relay (1.0) Calculated Property |
| Tfus | 263.31 | K | Relay (1.0) Calculated Property |
| Vc | 1.500 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1345.96; 1448.19] | J/mol×K | [945.98; 1162.69] |
|
| Cp,gas | 1345.96 | J/mol×K | 945.98 | Joback Calculated Property |
| Cp,gas | 1367.00 | J/mol×K | 982.10 | Joback Calculated Property |
| Cp,gas | 1386.38 | J/mol×K | 1018.22 | Joback Calculated Property |
| Cp,gas | 1404.14 | J/mol×K | 1054.33 | Joback Calculated Property |
| Cp,gas | 1420.33 | J/mol×K | 1090.45 | Joback Calculated Property |
| Cp,gas | 1435.00 | J/mol×K | 1126.57 | Joback Calculated Property |
| Cp,gas | 1448.19 | J/mol×K | 1162.69 | Joback Calculated Property |
| η | [0.0000180; 0.0005428] | Pa×s | [497.10; 945.98] |
|
| η | 0.0005428 | Pa×s | 497.10 | Joback Calculated Property |
| η | 0.0002121 | Pa×s | 571.91 | Joback Calculated Property |
| η | 0.0001030 | Pa×s | 646.73 | Joback Calculated Property |
| η | 0.0000581 | Pa×s | 721.54 | Joback Calculated Property |
| η | 0.0000365 | Pa×s | 796.35 | Joback Calculated Property |
| η | 0.0000248 | Pa×s | 871.17 | Joback Calculated Property |
| η | 0.0000180 | Pa×s | 945.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, heptadecyl 4-methylpent-2-yl ester.
Sources
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