- InChI
- InChI=1S/C5H11I/c1-3-5(2)4-6/h5H,3-4H2,1-2H3
- InChI Key
- RHBHXHXNWHTGSO-UHFFFAOYSA-N
- Formula
- C5H11I
- SMILES
- CCC(C)CI
- Molecular Weight1
- 198.05
- CAS
- 616-14-8
- Other Names
-
- 1-Iodo-2-methylbutane
- 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).
- 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).
- Pvap : Vapor 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 |
|---|---|---|---|
| ω | 0.2572 | Relay (1.0) Calculated Property | |
| ΔfG° | 46.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -94.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.468 | Crippen Calculated Property | |
| McVol | 107.130 | ml/mol | McGowan Calculated Property |
| Pc | 3411.87 | kPa | Joback Calculated Property |
| Inp | [896.00; 896.00] |
|
|
| Inp | 896.00 | NIST | |
| Inp | 896.00 | NIST | |
| I | 1120.00 | NIST | |
| Tboil | 415.53 | K | Relay (1.0) Calculated Property |
| Tc | 622.33 | K | Relay (1.0) Calculated Property |
| Tfus | 172.66 | K | Relay (1.0) Calculated Property |
| Vc | 0.372 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [172.15; 224.75] | J/mol×K | [406.50; 613.94] |
|
| Cp,gas | 172.15 | J/mol×K | 406.50 | Joback Calculated Property |
| Cp,gas | 182.14 | J/mol×K | 441.07 | Joback Calculated Property |
| Cp,gas | 191.61 | J/mol×K | 475.65 | Joback Calculated Property |
| Cp,gas | 200.59 | J/mol×K | 510.22 | Joback Calculated Property |
| Cp,gas | 209.09 | J/mol×K | 544.79 | Joback Calculated Property |
| Cp,gas | 217.13 | J/mol×K | 579.36 | Joback Calculated Property |
| Cp,gas | 224.75 | J/mol×K | 613.94 | Joback Calculated Property |
| η | [0.0003718; 0.0102765] | Pa×s | [189.17; 406.50] |
|
| η | 0.0102765 | Pa×s | 189.17 | Joback Calculated Property |
| η | 0.0037890 | Pa×s | 225.39 | Joback Calculated Property |
| η | 0.0018416 | Pa×s | 261.61 | Joback Calculated Property |
| η | 0.0010668 | Pa×s | 297.84 | Joback Calculated Property |
| η | 0.0006956 | Pa×s | 334.06 | Joback Calculated Property |
| η | 0.0004932 | Pa×s | 370.28 | Joback Calculated Property |
| η | 0.0003718 | Pa×s | 406.50 | Joback Calculated Property |
| ΔvapH | 39.80 | kJ/mol | 372.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [310.32; 456.98] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.39658e+01 | |||
| Coefficient B | -3.45573e+03 | |||
| Coefficient C | -5.76740e+01 | |||
| Temperature range, min. | 310.32 | |||
| Temperature range, max. | 456.98 | |||
| Pvap | 1.33 | kPa | 310.32 | Calculated Property |
| Pvap | 3.05 | kPa | 326.62 | Calculated Property |
| Pvap | 6.36 | kPa | 342.91 | Calculated Property |
| Pvap | 12.25 | kPa | 359.21 | Calculated Property |
| Pvap | 22.04 | kPa | 375.50 | Calculated Property |
| Pvap | 37.45 | kPa | 391.80 | Calculated Property |
| Pvap | 60.59 | kPa | 408.09 | Calculated Property |
| Pvap | 93.90 | kPa | 424.39 | Calculated Property |
| Pvap | 140.22 | kPa | 440.68 | Calculated Property |
| Pvap | 202.64 | kPa | 456.98 | Calculated Property |
Similar Compounds
Find more compounds similar to Butane, 1-iodo, 2-methyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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