- InChI
- InChI=1S/C21H42O4/c1-19(2)15-13-11-9-7-5-6-8-10-12-14-16-21(22)25-18-20(24-4)17-23-3/h19-20H,5-18H2,1-4H3
- InChI Key
- RRFJHCAFBDEFJJ-UHFFFAOYSA-N
- Formula
- C21H42O4
- SMILES
-
COCC(COC(=O)CCCCCCCCCCCCC(C)C)
OC - Molecular Weight1
- 358.56
- 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° | -322.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -996.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.54 | kJ/mol | Joback Calculated Property |
| log10WS | -5.52 | Crippen Calculated Property | |
| logPoct/wat | 5.528 | Crippen Calculated Property | |
| McVol | 325.930 | ml/mol | McGowan Calculated Property |
| Pc | 972.91 | kPa | Joback Calculated Property |
| Inp | [2234.00; 2234.00] |
|
|
| Inp | 2234.00 | NIST | |
| Inp | 2234.00 | NIST | |
| Tboil | 800.13 | K | Joback Calculated Property |
| Tc | 981.54 | K | Joback Calculated Property |
| Tfus | 413.05 | K | Joback Calculated Property |
| Vc | 1.260 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1036.84; 1140.02] | J/mol×K | [800.13; 981.54] |
|
| Cp,gas | 1036.84 | J/mol×K | 800.13 | Joback Calculated Property |
| Cp,gas | 1056.80 | J/mol×K | 830.36 | Joback Calculated Property |
| Cp,gas | 1075.65 | J/mol×K | 860.60 | Joback Calculated Property |
| Cp,gas | 1093.38 | J/mol×K | 890.83 | Joback Calculated Property |
| Cp,gas | 1110.01 | J/mol×K | 921.07 | Joback Calculated Property |
| Cp,gas | 1125.56 | J/mol×K | 951.30 | Joback Calculated Property |
| Cp,gas | 1140.02 | J/mol×K | 981.54 | Joback Calculated Property |
| η | [0.0000305; 0.0009966] | Pa×s | [413.05; 800.13] |
|
| η | 0.0009966 | Pa×s | 413.05 | Joback Calculated Property |
| η | 0.0003765 | Pa×s | 477.56 | Joback Calculated Property |
| η | 0.0001794 | Pa×s | 542.08 | Joback Calculated Property |
| η | 0.0001000 | Pa×s | 606.59 | Joback Calculated Property |
| η | 0.0000624 | Pa×s | 671.10 | Joback Calculated Property |
| η | 0.0000423 | Pa×s | 735.62 | Joback Calculated Property |
| η | 0.0000305 | Pa×s | 800.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycerol, 2,3-dimethyl, 1-(14-methylpentadecanoate).
Sources
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