- InChI
- InChI=1S/C10H22/c1-7-10(5,6)8-9(2,3)4/h7-8H2,1-6H3
- InChI Key
- PXHNHTBJHHSVPT-UHFFFAOYSA-N
- Formula
- C10H22
- SMILES
- CCC(C)(C)CC(C)(C)C
- Molecular Weight1
- 142.28
- CAS
- 51750-65-3
- Other Names
-
- 2,2,4,4-Tetramethylhexane
- 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).
- 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.
- 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 | 0.3548 | Relay (1.0) Calculated Property | |
| ΔfG° | 39.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -271.08 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 6.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.50 | kJ/mol | NIST |
| IE | 9.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.859 | Crippen Calculated Property | |
| McVol | 151.760 | ml/mol | McGowan Calculated Property |
| Pc | 2183.60 | kPa | Joback Calculated Property |
| Inp | [888.60; 900.00] |
|
|
| Inp | 889.00 | NIST | |
| Inp | 888.60 | NIST | |
| Inp | 888.80 | NIST | |
| Inp | Outlier 900.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Tboil | 421.41 | K | Relay (1.0) Calculated Property |
| Tc | 592.52 | K | Relay (1.0) Calculated Property |
| Tfus | 176.69 | K | Relay (1.0) Calculated Property |
| Vc | 0.554 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [318.50; 413.92] | J/mol×K | [421.74; 605.42] |
|
| Cp,gas | 318.50 | J/mol×K | 421.74 | Joback Calculated Property |
| Cp,gas | 336.71 | J/mol×K | 452.35 | Joback Calculated Property |
| Cp,gas | 353.94 | J/mol×K | 482.97 | Joback Calculated Property |
| Cp,gas | 370.23 | J/mol×K | 513.58 | Joback Calculated Property |
| Cp,gas | 385.63 | J/mol×K | 544.19 | Joback Calculated Property |
| Cp,gas | 400.18 | J/mol×K | 574.81 | Joback Calculated Property |
| Cp,gas | 413.92 | J/mol×K | 605.42 | Joback Calculated Property |
| η | [0.0002658; 0.0186536] | Pa×s | [207.30; 421.74] |
|
| η | 0.0186536 | Pa×s | 207.30 | Joback Calculated Property |
| η | 0.0054554 | Pa×s | 243.04 | Joback Calculated Property |
| η | 0.0021867 | Pa×s | 278.78 | Joback Calculated Property |
| η | 0.0010789 | Pa×s | 314.52 | Joback Calculated Property |
| η | 0.0006149 | Pa×s | 350.26 | Joback Calculated Property |
| η | 0.0003889 | Pa×s | 386.00 | Joback Calculated Property |
| η | 0.0002658 | Pa×s | 421.74 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [308.05; 456.79] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.41639e+01 | |||
| Coefficient B | -3.63699e+03 | |||
| Coefficient C | -4.59470e+01 | |||
| Temperature range, min. | 308.05 | |||
| Temperature range, max. | 456.79 | |||
| Pvap | 1.33 | kPa | 308.05 | Calculated Property |
| Pvap | 3.04 | kPa | 324.58 | Calculated Property |
| Pvap | 6.31 | kPa | 341.10 | Calculated Property |
| Pvap | 12.12 | kPa | 357.63 | Calculated Property |
| Pvap | 21.82 | kPa | 374.16 | Calculated Property |
| Pvap | 37.11 | kPa | 390.68 | Calculated Property |
| Pvap | 60.13 | kPa | 407.21 | Calculated Property |
| Pvap | 93.40 | kPa | 423.74 | Calculated Property |
| Pvap | 139.82 | kPa | 440.26 | Calculated Property |
| Pvap | 202.64 | kPa | 456.79 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexane, 2,2,4,4-tetramethyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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