- InChI
- InChI=1S/C7H13IO2/c1-2-3-4-7(9)10-6-5-8/h2-6H2,1H3
- InChI Key
- VLKAEOLCZKBFBS-UHFFFAOYSA-N
- Formula
- C7H13IO2
- SMILES
- CCCCC(=O)OCCI
- Molecular Weight1
- 256.08
- 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 | 0.5377 | Relay (1.0) Calculated Property | |
| ΔfG° | -244.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -425.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.62 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.155 | Crippen Calculated Property | |
| McVol | 142.750 | ml/mol | McGowan Calculated Property |
| Pc | 2749.78 | kPa | Joback Calculated Property |
| Inp | [1250.00; 1250.00] |
|
|
| Inp | 1250.00 | NIST | |
| Inp | 1250.00 | NIST | |
| Tboil | 496.55 | K | Relay (1.0) Calculated Property |
| Tc | 704.43 | K | Relay (1.0) Calculated Property |
| Tfus | 226.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.513 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [284.91; 344.80] | J/mol×K | [511.12; 714.81] |
|
| Cp,gas | 284.91 | J/mol×K | 511.12 | Joback Calculated Property |
| Cp,gas | 296.31 | J/mol×K | 545.07 | Joback Calculated Property |
| Cp,gas | 307.13 | J/mol×K | 579.02 | Joback Calculated Property |
| Cp,gas | 317.37 | J/mol×K | 612.96 | Joback Calculated Property |
| Cp,gas | 327.06 | J/mol×K | 646.91 | Joback Calculated Property |
| Cp,gas | 336.19 | J/mol×K | 680.86 | Joback Calculated Property |
| Cp,gas | 344.80 | J/mol×K | 714.81 | Joback Calculated Property |
| η | [0.0002731; 0.0055882] | Pa×s | [269.04; 511.12] |
|
| η | 0.0055882 | Pa×s | 269.04 | Joback Calculated Property |
| η | 0.0024339 | Pa×s | 309.39 | Joback Calculated Property |
| η | 0.0012842 | Pa×s | 349.73 | Joback Calculated Property |
| η | 0.0007734 | Pa×s | 390.08 | Joback Calculated Property |
| η | 0.0005122 | Pa×s | 430.43 | Joback Calculated Property |
| η | 0.0003641 | Pa×s | 470.77 | Joback Calculated Property |
| η | 0.0002731 | Pa×s | 511.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanoic acid, 2-iodoethyl ester.
Sources
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