- InChI
- InChI=1S/C6H13I/c1-5(2)6(3,4)7/h5H,1-4H3
- InChI Key
- PRNFUXYRTWHXNG-UHFFFAOYSA-N
- Formula
- C6H13I
- SMILES
- CC(C)C(C)(C)I
- Molecular Weight1
- 212.07
- CAS
- 594-59-2
- Other Names
-
- 2,3-Dimethyl-2-iodobutane
- 2-Iodo-2,3-dimethylbutane
- 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).
- Pvap : Vapor pressure (kPa).
- 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° | 58.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -104.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 4.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.15 | Crippen Calculated Property | |
| logPoct/wat | 2.856 | Crippen Calculated Property | |
| McVol | 121.220 | ml/mol | McGowan Calculated Property |
| Pc | 3124.49 | kPa | Joback Calculated Property |
| Tboil | 426.15 | K | Joback Calculated Property |
| Tc | 645.85 | K | Joback Calculated Property |
| Tfus | 202.86 | K | Joback Calculated Property |
| Vc | 0.443 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [212.03; 276.89] | J/mol×K | [426.15; 645.85] | 
|
| Cp,gas | 212.03 | J/mol×K | 426.15 | Joback Calculated Property |
| Cp,gas | 224.82 | J/mol×K | 462.77 | Joback Calculated Property |
| Cp,gas | 236.75 | J/mol×K | 499.38 | Joback Calculated Property |
| Cp,gas | 247.88 | J/mol×K | 536.00 | Joback Calculated Property |
| Cp,gas | 258.24 | J/mol×K | 572.61 | Joback Calculated Property |
| Cp,gas | 267.89 | J/mol×K | 609.23 | Joback Calculated Property |
| Cp,gas | 276.89 | J/mol×K | 645.85 | Joback Calculated Property |
| η | [0.0003672; 0.0181053] | Pa×s | [202.86; 426.15] |
|
| η | 0.0181053 | Pa×s | 202.86 | Joback Calculated Property |
| η | 0.0057143 | Pa×s | 240.08 | Joback Calculated Property |
| η | 0.0024579 | Pa×s | 277.29 | Joback Calculated Property |
| η | 0.0012908 | Pa×s | 314.50 | Joback Calculated Property |
| η | 0.0007769 | Pa×s | 351.72 | Joback Calculated Property |
| η | 0.0005153 | Pa×s | 388.94 | Joback Calculated Property |
| η | 0.0003672 | Pa×s | 426.15 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [323.92; 479.21] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.37723e+01 | |||
| Coefficient B | -3.52652e+03 | |||
| Coefficient C | -6.24000e+01 | |||
| Temperature range, min. | 323.92 | |||
| Temperature range, max. | 479.21 | |||
| Pvap | 1.33 | kPa | 323.92 | Calculated Property |
| Pvap | 3.07 | kPa | 341.17 | Calculated Property |
| Pvap | 6.42 | kPa | 358.43 | Calculated Property |
| Pvap | 12.37 | kPa | 375.68 | Calculated Property |
| Pvap | 22.27 | kPa | 392.94 | Calculated Property |
| Pvap | 37.81 | kPa | 410.19 | Calculated Property |
| Pvap | 61.06 | kPa | 427.45 | Calculated Property |
| Pvap | 94.43 | kPa | 444.70 | Calculated Property |
| Pvap | 140.64 | kPa | 461.96 | Calculated Property |
| Pvap | 202.66 | kPa | 479.21 | Calculated Property |
Similar Compounds
Find more compounds similar to Butane, 2-iodo-2,3-dimethyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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