- InChI
- InChI=1S/C5H11I/c1-5(2)3-4-6/h5H,3-4H2,1-2H3
- InChI Key
- BUZZUHJODKQYTF-UHFFFAOYSA-N
- Formula
- C5H11I
- SMILES
- CC(C)CCI
- Molecular Weight1
- 198.05
- CAS
- 541-28-6
- Other Names
-
- 1-Iodo-3-methylbutane
- 1-Jod-3-methylbutan
- 3-Methylbutyliodide
- 4-Iodo-2-methylbutane
- CH2ICH2CH(CH3)2
- Isopentyl iodide
- iso-Amyliodide
- isoamyl iodide
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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 | 0.2680 | Relay (1.0) Calculated Property | |
| ΔfG° | 46.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -77.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.20 | kJ/mol | NIST |
| IE | [9.17; 9.20] | eV |
|
| IE | 9.18 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.19 | eV | NIST |
| IE | 9.17 ± 0.01 | eV | NIST |
| log10WS | -3.51 | 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 | 884.00 | NIST | |
| I | [1108.00; 1108.00] |
|
|
| I | 1108.00 | NIST | |
| I | 1108.00 | NIST | |
| Tboil | [419.00; 420.80] | K |
|
| Tboil | 419.00 ± 3.00 | K | NIST |
| Tboil | 420.80 ± 0.25 | K | NIST |
| Tboil | 420.80 ± 0.50 | K | NIST |
| Tboil | 420.80 ± 0.50 | K | NIST |
| Tboil | 420.80 ± 0.50 | K | NIST |
| Tc | 619.70 | K | Relay (1.0) Calculated Property |
| Tfus | 168.19 | K | Relay (1.0) Calculated Property |
| Vc | 0.374 | 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 |
| Cp,liquid | 178.70 | J/mol×K | 298.00 | NIST |
| 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 | 43.50 | kJ/mol | 346.00 | NIST |
| Pvap | [0.04; 1.16] | kPa | [253.67; 303.29] |
|
| Pvap | 0.04 | kPa | 253.67 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.04 | kPa | 253.68 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.04 | kPa | 253.70 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.06 | kPa | 258.62 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.06 | kPa | 258.62 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.13 | kPa | 268.98 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.13 | kPa | 269.10 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.18 | kPa | 273.61 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.18 | kPa | 273.61 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.18 | kPa | 273.61 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.25 | kPa | 278.56 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.25 | kPa | 278.57 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.25 | kPa | 278.58 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.35 | kPa | 283.55 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.35 | kPa | 283.55 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.35 | kPa | 283.56 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.48 | kPa | 288.52 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.48 | kPa | 288.53 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.48 | kPa | 288.54 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.66 | kPa | 293.55 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.66 | kPa | 293.55 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.66 | kPa | 293.57 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.87 | kPa | 298.43 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.88 | kPa | 298.44 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 0.88 | kPa | 298.44 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 1.16 | kPa | 303.29 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 1.16 | kPa | 303.29 | Vapor Pressure of Selected Organic Iodides |
| Pvap | 1.16 | kPa | 303.29 | Vapor Pressure of Selected Organic Iodides |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [312.08; 445.08] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.48981e+01 | |||
| Coefficient B | -3.70808e+03 | |||
| Coefficient C | -5.82850e+01 | |||
| Temperature range, min. | 312.08 | |||
| Temperature range, max. | 445.08 | |||
| Pvap | 1.33 | kPa | 312.08 | Calculated Property |
| Pvap | 2.98 | kPa | 326.86 | Calculated Property |
| Pvap | 6.12 | kPa | 341.64 | Calculated Property |
| Pvap | 11.71 | kPa | 356.41 | Calculated Property |
| Pvap | 21.07 | kPa | 371.19 | Calculated Property |
| Pvap | 35.95 | kPa | 385.97 | Calculated Property |
| Pvap | 58.58 | kPa | 400.75 | Calculated Property |
| Pvap | 91.68 | kPa | 415.52 | Calculated Property |
| Pvap | 138.47 | kPa | 430.30 | Calculated Property |
| Pvap | 202.65 | kPa | 445.08 | Calculated Property |
Similar Compounds
Find more compounds similar to Butane, 1-iodo-3-methyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Vapor Pressure of Selected Organic Iodides
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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