- InChI
- InChI=1S/C8H15IO2/c1-2-3-4-7-11-8(10)5-6-9/h2-7H2,1H3
- InChI Key
- TVIQIONYLJULRP-UHFFFAOYSA-N
- Formula
- C8H15IO2
- SMILES
- CCCCCOC(=O)CCI
- Molecular Weight1
- 270.11
- 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 | 0.5742 | Relay (1.0) Calculated Property | |
| ΔfG° | -159.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -447.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.545 | Crippen Calculated Property | |
| McVol | 156.840 | ml/mol | McGowan Calculated Property |
| Pc | 2597.78 | kPa | Joback Calculated Property |
| Inp | [1420.00; 1420.00] |
|
|
| Inp | 1420.00 | NIST | |
| Inp | 1420.00 | NIST | |
| Tboil | 517.68 | K | Relay (1.0) Calculated Property |
| Tc | 716.85 | K | Relay (1.0) Calculated Property |
| Tfus | 240.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.560 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [332.40; 396.37] | J/mol×K | [551.87; 755.24] |
|
| Cp,gas | 332.40 | J/mol×K | 551.87 | Joback Calculated Property |
| Cp,gas | 344.49 | J/mol×K | 585.76 | Joback Calculated Property |
| Cp,gas | 356.00 | J/mol×K | 619.66 | Joback Calculated Property |
| Cp,gas | 366.92 | J/mol×K | 653.55 | Joback Calculated Property |
| Cp,gas | 377.28 | J/mol×K | 687.45 | Joback Calculated Property |
| Cp,gas | 387.10 | J/mol×K | 721.34 | Joback Calculated Property |
| Cp,gas | 396.37 | J/mol×K | 755.24 | Joback Calculated Property |
| η | [0.0002646; 0.0033031] | Pa×s | [310.14; 551.87] |
|
| η | 0.0033031 | Pa×s | 310.14 | Joback Calculated Property |
| η | 0.0017028 | Pa×s | 350.43 | Joback Calculated Property |
| η | 0.0010063 | Pa×s | 390.72 | Joback Calculated Property |
| η | 0.0006562 | Pa×s | 431.00 | Joback Calculated Property |
| η | 0.0004603 | Pa×s | 471.29 | Joback Calculated Property |
| η | 0.0003415 | Pa×s | 511.58 | Joback Calculated Property |
| η | 0.0002646 | Pa×s | 551.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propionic acid, 3-iodo-, pentyl ester.
Sources
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