- InChI
- InChI=1S/C5H11I/c1-4-5(2,3)6/h4H2,1-3H3
- InChI Key
- NWRZTQFWFPLHHX-UHFFFAOYSA-N
- Formula
- C5H11I
- SMILES
- CCC(C)(C)I
- Molecular Weight1
- 198.05
- CAS
- 594-38-7
- Other Names
-
- Butane, 2-iodo-2-methyl
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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.
- I : 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° | 52.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -78.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 5.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.80 | kJ/mol | Joback Calculated Property |
| IE | [8.93; 8.93] | eV |
|
| IE | 8.93 | eV | NIST |
| IE | 8.93 ± 0.01 | eV | NIST |
| log10WS | -2.98 | Crippen Calculated Property | |
| logPoct/wat | 2.610 | Crippen Calculated Property | |
| McVol | 107.130 | ml/mol | McGowan Calculated Property |
| Pc | 3456.14 | kPa | Joback Calculated Property |
| Inp | [829.00; 829.00] |
|
|
| Inp | 829.00 | NIST | |
| Inp | 829.00 | NIST | |
| I | [1092.00; 1092.00] |
|
|
| I | 1092.00 | NIST | |
| I | 1092.00 | NIST | |
| Tboil | 397.70 | K | NIST |
| Tc | 620.61 | K | Joback Calculated Property |
| Tfus | 206.59 | K | Joback Calculated Property |
| Vc | 0.393 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [174.23; 230.17] | J/mol×K | [403.71; 620.61] |
|
| Cp,gas | 174.23 | J/mol×K | 403.71 | Joback Calculated Property |
| Cp,gas | 185.30 | J/mol×K | 439.86 | Joback Calculated Property |
| Cp,gas | 195.61 | J/mol×K | 476.01 | Joback Calculated Property |
| Cp,gas | 205.21 | J/mol×K | 512.16 | Joback Calculated Property |
| Cp,gas | 214.14 | J/mol×K | 548.31 | Joback Calculated Property |
| Cp,gas | 222.44 | J/mol×K | 584.46 | Joback Calculated Property |
| Cp,gas | 230.17 | J/mol×K | 620.61 | Joback Calculated Property |
| η | [0.0004201; 0.0108874] | Pa×s | [206.59; 403.71] |
|
| η | 0.0108874 | Pa×s | 206.59 | Joback Calculated Property |
| η | 0.0043620 | Pa×s | 239.44 | Joback Calculated Property |
| η | 0.0021792 | Pa×s | 272.30 | Joback Calculated Property |
| η | 0.0012642 | Pa×s | 305.15 | Joback Calculated Property |
| η | 0.0008153 | Pa×s | 338.00 | Joback Calculated Property |
| η | 0.0005683 | Pa×s | 370.86 | Joback Calculated Property |
| η | 0.0004201 | Pa×s | 403.71 | Joback Calculated Property |
| ΔvapH | 40.40 | kJ/mol | 353.00 | NIST |
Similar Compounds
Find more compounds similar to 2-Iodo-2-methylbutane.
Sources
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