- InChI
- InChI=1S/C5H9IO2/c1-4(2)8-5(7)3-6/h4H,3H2,1-2H3
- InChI Key
- AGQAITFOQLGIGK-UHFFFAOYSA-N
- Formula
- C5H9IO2
- SMILES
- CC(C)OC(=O)CI
- Molecular Weight1
- 228.03
- Other Names
-
- propan-2-yl iodoacetate
- Isopropyl iodoacetate
- 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° | -187.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -319.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.86 | kJ/mol | Joback Calculated Property |
| log10WS | -1.84 | Crippen Calculated Property | |
| logPoct/wat | 1.373 | Crippen Calculated Property | |
| McVol | 114.570 | ml/mol | McGowan Calculated Property |
| Pc | 3602.88 | kPa | Joback Calculated Property |
| Inp | 999.90 | NIST | |
| Tboil | 482.79 | K | Joback Calculated Property |
| Tc | 700.64 | K | Joback Calculated Property |
| Tfus | 261.33 | K | Joback Calculated Property |
| Vc | 0.421 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [205.38; 252.77] | J/mol×K | [482.79; 700.64] | 
|
| Cp,gas | 205.38 | J/mol×K | 482.79 | Joback Calculated Property |
| Cp,gas | 214.35 | J/mol×K | 519.10 | Joback Calculated Property |
| Cp,gas | 222.88 | J/mol×K | 555.41 | Joback Calculated Property |
| Cp,gas | 230.98 | J/mol×K | 591.71 | Joback Calculated Property |
| Cp,gas | 238.66 | J/mol×K | 628.02 | Joback Calculated Property |
| Cp,gas | 245.92 | J/mol×K | 664.33 | Joback Calculated Property |
| Cp,gas | 252.77 | J/mol×K | 700.64 | Joback Calculated Property |
| η | [0.0003398; 0.0050974] | Pa×s | [261.33; 482.79] |
|
| η | 0.0050974 | Pa×s | 261.33 | Joback Calculated Property |
| η | 0.0024550 | Pa×s | 298.24 | Joback Calculated Property |
| η | 0.0013888 | Pa×s | 335.15 | Joback Calculated Property |
| η | 0.0008796 | Pa×s | 372.06 | Joback Calculated Property |
| η | 0.0006050 | Pa×s | 408.97 | Joback Calculated Property |
| η | 0.0004428 | Pa×s | 445.88 | Joback Calculated Property |
| η | 0.0003398 | Pa×s | 482.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to acetic acid, 2-iodo-, 1-methylethyl ester.
Sources
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