- InChI
- InChI=1S/C19H37IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-19(21)16-17-20/h2-18H2,1H3
- InChI Key
- AMBMHTVKDPBYIM-UHFFFAOYSA-N
- Formula
- C19H37IO2
- SMILES
- CCCCCCCCCCCCCCCCOC(=O)CCI
- Molecular Weight1
- 424.40
- 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 | 0.9718 | Relay (1.0) Calculated Property | |
| ΔfG° | -66.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -685.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 52.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.36 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.11 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.836 | Crippen Calculated Property | |
| McVol | 311.830 | ml/mol | McGowan Calculated Property |
| Pc | 1097.90 | kPa | Joback Calculated Property |
| Inp | [2578.00; 2578.00] |
|
|
| Inp | 2578.00 | NIST | |
| Inp | 2578.00 | NIST | |
| Tboil | 636.56 | K | Relay (1.0) Calculated Property |
| Tc | 823.71 | K | Relay (1.0) Calculated Property |
| Tfus | 308.40 | K | Relay (1.0) Calculated Property |
| Vc | 1.173 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [919.94; 1013.24] | J/mol×K | [803.55; 992.65] |
|
| Cp,gas | 919.94 | J/mol×K | 803.55 | Joback Calculated Property |
| Cp,gas | 937.77 | J/mol×K | 835.07 | Joback Calculated Property |
| Cp,gas | 954.64 | J/mol×K | 866.58 | Joback Calculated Property |
| Cp,gas | 970.59 | J/mol×K | 898.10 | Joback Calculated Property |
| Cp,gas | 985.65 | J/mol×K | 929.62 | Joback Calculated Property |
| Cp,gas | 999.85 | J/mol×K | 961.14 | Joback Calculated Property |
| Cp,gas | 1013.24 | J/mol×K | 992.65 | Joback Calculated Property |
| η | [0.0000613; 0.0012187] | Pa×s | [434.11; 803.55] |
|
| η | 0.0012187 | Pa×s | 434.11 | Joback Calculated Property |
| η | 0.0005433 | Pa×s | 495.68 | Joback Calculated Property |
| η | 0.0002896 | Pa×s | 557.26 | Joback Calculated Property |
| η | 0.0001749 | Pa×s | 618.83 | Joback Calculated Property |
| η | 0.0001158 | Pa×s | 680.40 | Joback Calculated Property |
| η | 0.0000820 | Pa×s | 741.98 | Joback Calculated Property |
| η | 0.0000613 | Pa×s | 803.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propionic acid, 3-iodo-, hexadecyl ester.
Sources
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