- InChI
- InChI=1S/C22H44O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(23)26-20-21(25-3)19-24-2/h21H,4-20H2,1-3H3
- InChI Key
- LAVHQUSMQCEMCR-UHFFFAOYSA-N
- Formula
- C22H44O4
- SMILES
-
CCCCCCCCCCCCCCCCC(=O)OCC(COC)O
C - Molecular Weight1
- 372.58
- 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 | 1.0600 | Relay (... Calculated Property | |
| ΔfG° | -312.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1035.29 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 54.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.74 | kJ/mol | Relay (... Calculated Property |
| IE | 9.55 | eV | Relay (... Calculated Property |
| log10WS | -5.71 | Relay (... Calculated Property | |
| logPoct/wat | 6.062 | Crippen Calculated Property | |
| McVol | 340.020 | ml/mol | McGowan Calculated Property |
| Pc | 912.73 | kPa | Joback Calculated Property |
| Inp | [2371.00; 2371.00] |
|
|
| Inp | 2371.00 | NIST | |
| Inp | 2371.00 | NIST | |
| Tboil | 630.48 | K | Relay (... Calculated Property |
| Tc | 806.00 | K | Relay (... Calculated Property |
| Tfus | 296.51 | K | Relay (... Calculated Property |
| Vc | 1.301 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1098.67; 1203.23] | J/mol×K | [823.45; 1008.38] |
|
| Cp,gas | 1098.67 | J/mol×K | 823.45 | Joback Calculated Property |
| Cp,gas | 1119.03 | J/mol×K | 854.27 | Joback Calculated Property |
| Cp,gas | 1138.20 | J/mol×K | 885.09 | Joback Calculated Property |
| Cp,gas | 1156.19 | J/mol×K | 915.91 | Joback Calculated Property |
| Cp,gas | 1173.02 | J/mol×K | 946.74 | Joback Calculated Property |
| Cp,gas | 1188.69 | J/mol×K | 977.56 | Joback Calculated Property |
| Cp,gas | 1203.23 | J/mol×K | 1008.38 | Joback Calculated Property |
| η | [0.0000287; 0.0007170] | Pa×s | [439.32; 823.45] |
|
| η | 0.0007170 | Pa×s | 439.32 | Joback Calculated Property |
| η | 0.0002980 | Pa×s | 503.34 | Joback Calculated Property |
| η | 0.0001510 | Pa×s | 567.36 | Joback Calculated Property |
| η | 0.0000878 | Pa×s | 631.38 | Joback Calculated Property |
| η | 0.0000565 | Pa×s | 695.41 | Joback Calculated Property |
| η | 0.0000391 | Pa×s | 759.43 | Joback Calculated Property |
| η | 0.0000287 | Pa×s | 823.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycerol, 2,3-dimethyl, 1-heptadecanoate.
Sources
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