- InChI
- InChI=1S/C8H18/c1-5-8(4,6-2)7-3/h5-7H2,1-4H3
- InChI Key
- GIEZWIDCIFCQPS-UHFFFAOYSA-N
- Formula
- C8H18
- SMILES
- CCC(C)(CC)CC
- Molecular Weight1
- 114.23
- CAS
- 1067-08-9
- Other Names
-
- 3-Ethyl-3-methylpentane
- 3-Methyl-3-ethylpentane
- ω : Acentric Factor.
- AP : Aniline Point (K).
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- μ : Dipole Moment (debye).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- Δc,grossH : Heat of Combustion, Gross form (kJ/mol).
- Δc,netH : Heat of Combustion, Net Form (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase 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).
- Ptriple : Triple Point Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- n0 : Refractive Index.
- ρc : Critical density (kg/m3).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- γ : Surface Tension (N/m).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- λgas : Gas thermal conductivity (W/m×K).
- λliquid : Liquid thermal conductivity (W/m×K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- UQi : UNIQUAC Qi Parameter.
- URi : UNIQUAC Ri Parameter.
- Vc : Critical Volume (m3/kmol).
- Zc : Critical Compressibility.
- Zra : Rackett Parameter.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | [0.3009; 0.3050] |
|
|
| ω | 0.3009 | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value | |
| ω | 0.3037 | Passut and Danner (1973), critical constants and acentric factors Compiled value | |
| ω | 0.3050 | ChemSep v8.3 pure component data Compiled value | |
| ω | 0.3030 | KDB | |
| AP | 339.050 | K | KDB |
| ΔcH°liquid | -5467.70 ± 1.10 | kJ/mol | NIST |
| μ | 0.00 | debye | ChemSep v8.3 pure component data Compiled value |
| ΔfG° | [19.93; 22.88] | kJ/mol |
|
| ΔfG° | 22.88 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfG° | 19.93 | kJ/mol | KDB |
| Δc,grossH | 5467.65 | kJ/mol | KDB |
| Δc,netH | 5071.510 | kJ/mol | KDB |
| ΔfH°gas | [-215.10; -214.85] | kJ/mol |
|
| ΔfH°gas | -214.85 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfH°gas | -215.10 | kJ/mol | KDB |
| ΔfH°gas | -215.00 ± 1.30 | kJ/mol | NIST |
| ΔfH°liquid | -253.00 ± 1.30 | kJ/mol | NIST |
| ΔfusH° | 9.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [37.98; 38.05] | kJ/mol |
|
| ΔvapH° | 38.05 | kJ/mol | NIST |
| ΔvapH° | 38.00 | kJ/mol | NIST |
| ΔvapH° | 38.00 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 37.98 | kJ/mol | NIST |
| IE | 9.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.27 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.223 | Crippen Calculated Property | |
| McVol | 123.580 | ml/mol | McGowan Calculated Property |
| Pc | [2807.30; 2810.00] | kPa |
|
| Pc | 2810.00 | kPa | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 5 Compiled value |
| Pc | 2809.74 | kPa | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Pc | 2807.55 | kPa | Passut and Danner (1973), critical constants and acentric factors Compiled value |
| Pc | 2810.00 | kPa | ChemSep v8.3 pure component data Compiled value |
| Pc | 2810.00 | kPa | KDB |
| Pc | 2810.00 ± 40.00 | kPa | NIST |
| Pc | 2807.30 ± 40.53 | kPa | NIST |
| Ptriple | 6.25e-05 | kPa | ChemSep v8.3 pure component data Compiled value |
| ρc | [251.30; 251.30] | kg/m3 |
|
| ρc | 251.30 ± 4.57 | kg/m3 | NIST |
| ρc | 251.30 ± 4.57 | kg/m3 | NIST |
| Inp | [763.06; 783.00] |
|
|
| Inp | 765.00 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 772.00 | NIST | |
| Inp | 773.80 | NIST | |
| Inp | 776.90 | NIST | |
| Inp | 768.40 | NIST | |
| Inp | 769.30 | NIST | |
| Inp | 770.20 | NIST | |
| Inp | 771.20 | NIST | |
| Inp | 772.00 | NIST | |
| Inp | 772.20 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 780.00 | NIST | |
| Inp | 780.00 | NIST | |
| Inp | 778.60 | NIST | |
| Inp | 776.00 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | 778.00 | NIST | |
| Inp | 774.10 | NIST | |
| Inp | 781.00 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 780.00 | NIST | |
| Inp | 772.00 | NIST | |
| Inp | 769.00 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | 777.00 | NIST | |
| Inp | 781.00 | NIST | |
| Inp | 770.00 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | 778.00 | NIST | |
| Inp | 772.00 | NIST | |
| Inp | 775.00 | NIST | |
| Inp | 778.00 | NIST | |
| Inp | 764.00 | NIST | |
| Inp | 766.50 | NIST | |
| Inp | 768.40 | NIST | |
| Inp | 765.42 | NIST | |
| Inp | 766.00 | NIST | |
| Inp | 763.06 | NIST | |
| Inp | 765.47 | NIST | |
| Inp | 766.94 | NIST | |
| Inp | 764.38 | NIST | |
| Inp | 766.76 | NIST | |
| Inp | 768.22 | NIST | |
| Inp | 764.00 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | Outlier 783.00 | NIST | |
| Inp | 778.00 | NIST | |
| Inp | 773.00 | NIST | |
| Inp | 770.00 | NIST | |
| Inp | 768.00 | NIST | |
| Inp | 770.00 | NIST | |
| Inp | 781.00 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | 776.00 | NIST | |
| Inp | 766.00 | NIST | |
| Inp | 765.00 | NIST | |
| Inp | 764.00 | NIST | |
| Inp | 768.40 | NIST | |
| Inp | 766.94 | NIST | |
| Inp | 774.00 | NIST | |
| Inp | 781.00 | NIST | |
| Inp | 764.00 | NIST | |
| Tboil | [391.18; 391.95] | K |
|
| Tboil | 391.42 | K | ChemSep v8.3 pure component data Compiled value |
| Tboil | 391.42 | K | KDB |
| Tboil | 391.40 | K | NIST |
| Tboil | 391.40 | K | NIST |
| Tboil | 391.41 ± 0.20 | K | NIST |
| Tboil | 391.53 ± 0.20 | K | NIST |
| Tboil | 391.60 ± 0.30 | K | NIST |
| Tboil | 391.20 ± 0.30 | K | NIST |
| Tboil | 391.43 ± 0.20 | K | NIST |
| Tboil | Outlier 391.95 ± 0.30 | K | NIST |
| Tboil | 391.18 ± 0.30 | K | NIST |
| Tboil | 391.43 ± 0.15 | K | NIST |
| Tboil | 391.43 ± 0.30 | K | NIST |
| Tboil | 391.40 ± 0.02 | K | NIST |
| Tboil | 391.41 ± 0.05 | K | NIST |
| Tboil | 391.65 ± 0.30 | K | NIST |
| Tboil | 391.55 ± 0.60 | K | NIST |
| Tboil | 391.50 ± 0.20 | K | NIST |
| Tboil | 391.55 ± 0.20 | K | NIST |
| Tc | [576.50; 576.58] | K |
|
| Tc | 576.50 | K | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 5 Compiled value |
| Tc | 576.50 | K | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Tc | Outlier 576.58 | K | Passut and Danner (1973), critical constants and acentric factors Compiled value |
| Tc | 576.50 | K | ChemSep v8.3 pure component data Compiled value |
| Tc | 576.50 | K | KDB |
| Tc | 576.50 ± 0.50 | K | NIST |
| Tc | 576.50 | K | NIST |
| Tc | 576.51 ± 0.40 | K | NIST |
| Tfus | [182.05; 183.45] | K |
|
| Tfus | 182.20 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 182.28 | K | ChemSep v8.3 pure component data Compiled value |
| Tfus | 182.20 | K | KDB |
| Tfus | 182.65 ± 0.30 | K | NIST |
| Tfus | 182.68 ± 0.20 | K | NIST |
| Tfus | 183.12 ± 0.30 | K | NIST |
| Tfus | 182.22 ± 0.20 | K | NIST |
| Tfus | 182.24 ± 0.02 | K | NIST |
| Tfus | 182.26 ± 0.05 | K | NIST |
| Tfus | 182.26 ± 0.04 | K | NIST |
| Tfus | 182.28 ± 0.02 | K | NIST |
| Tfus | Outlier 183.45 ± 0.40 | K | NIST |
| Tfus | 182.25 ± 0.40 | K | NIST |
| Tfus | 182.05 ± 0.40 | K | NIST |
| Tfus | 182.25 ± 0.40 | K | NIST |
| Ttriple | 182.28 | K | ChemSep v8.3 pure component data Compiled value |
| UQi | 5.01 | ChemSep v8.3 pure component data Compiled value | |
| URi | 5.85 | ChemSep v8.3 pure component data Compiled value | |
| Vc | [0.455; 0.455] | m3/kmol |
|
| Vc | 0.455 | m3/kmol | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 5 Compiled value |
| Vc | 0.455 | m3/kmol | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Vc | 0.455 | m3/kmol | ChemSep v8.3 pure component data Compiled value |
| Vc | 0.455 | m3/kmol | KDB |
| Vc | 0.455 | m3/kmol | NIST |
| Zc | [0.2660000; 0.2670000] |
|
|
| Zc | 0.2660000 | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 5 Compiled value | |
| Zc | 0.2670000 | ChemSep v8.3 pure component data Compiled value | |
| Zc | 0.2667360 | KDB | |
| Zra | 0.27 | ChemSep v8.3 pure component data Compiled value |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [247.27; 303.76] | J/mol×K | [403.30; 521.70] |
|
| Cp,gas | 247.27 | J/mol×K | 403.30 | NIST |
| Cp,gas | 275.73 | J/mol×K | 462.60 | NIST |
| Cp,gas | 303.76 | J/mol×K | 521.70 | NIST |
| ΔvapH | [32.78; 40.20] | kJ/mol | [320.00; 391.40] |
|
| ΔvapH | 40.20 | kJ/mol | 320.00 | NIST |
| ΔvapH | 36.90 | kJ/mol | 352.50 | NIST |
| ΔvapH | 32.79 | kJ/mol | 391.40 | KDB |
| ΔvapH | 32.78 | kJ/mol | 391.40 | NIST |
| n0 | 1.40549 | 298.15 | KDB | |
| ρl | 727.00 | kg/m3 | 293.00 | KDB |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [107.33; 529.35] | J/mol×K | [150.00; 1500.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 8.97150e+01 | |||
| Coefficient B | -5.09110e+02 | |||
| Coefficient C | 6.22724e+00 | |||
| Coefficient D | 2.48580e-04 | |||
| Coefficient E | -7.76700e-08 | |||
| Temperature range, min. | 150.00 | |||
| Temperature range, max. | 1500.00 | |||
| Cp,gas | 107.33 | J/mol×K | 150.00 | Calculated Property |
| Cp,gas | 188.98 | J/mol×K | 300.00 | Calculated Property |
| Cp,gas | 269.55 | J/mol×K | 450.00 | Calculated Property |
| Cp,gas | 334.39 | J/mol×K | 600.00 | Calculated Property |
| Cp,gas | 385.96 | J/mol×K | 750.00 | Calculated Property |
| Cp,gas | 427.49 | J/mol×K | 900.00 | Calculated Property |
| Cp,gas | 461.29 | J/mol×K | 1050.00 | Calculated Property |
| Cp,gas | 488.91 | J/mol×K | 1200.00 | Calculated Property |
| Cp,gas | 511.36 | J/mol×K | 1350.00 | Calculated Property |
| Cp,gas | 529.35 | J/mol×K | 1500.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [204.10; 291.08] | J/mol×K | [201.78; 381.78] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,liquid in J/mol×K, T in K | |||
| Coefficient A | 7.77690e+01 | |||
| Coefficient B | 1.72950e+02 | |||
| Coefficient C | 2.27424e+00 | |||
| Coefficient D | 1.02100e-02 | |||
| Coefficient E | -8.66150e-06 | |||
| Temperature range, min. | 201.78 | |||
| Temperature range, max. | 381.78 | |||
| Cp,liquid | 204.10 | J/mol×K | 201.78 | Calculated Property |
| Cp,liquid | 211.04 | J/mol×K | 221.78 | Calculated Property |
| Cp,liquid | 219.20 | J/mol×K | 241.78 | Calculated Property |
| Cp,liquid | 228.29 | J/mol×K | 261.78 | Calculated Property |
| Cp,liquid | 238.11 | J/mol×K | 281.78 | Calculated Property |
| Cp,liquid | 248.43 | J/mol×K | 301.78 | Calculated Property |
| Cp,liquid | 259.09 | J/mol×K | 321.78 | Calculated Property |
| Cp,liquid | 269.88 | J/mol×K | 341.78 | Calculated Property |
| Cp,liquid | 280.61 | J/mol×K | 361.78 | Calculated Property |
| Cp,liquid | 291.08 | J/mol×K | 381.78 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0052388; 0.0001986] | Pa×s | [182.28; 400.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.85900e+01 | |||
| Coefficient B | 1.27030e+03 | |||
| Coefficient C | 1.24670e+00 | |||
| Coefficient D | -3.62260e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 400.00 | |||
| η | 0.0052388 | Pa×s | 182.28 | Calculated Property |
| η | 0.0026140 | Pa×s | 206.47 | Calculated Property |
| η | 0.0015150 | Pa×s | 230.66 | Calculated Property |
| η | 0.0009748 | Pa×s | 254.85 | Calculated Property |
| η | 0.0006761 | Pa×s | 279.04 | Calculated Property |
| η | 0.0004956 | Pa×s | 303.24 | Calculated Property |
| η | 0.0003787 | Pa×s | 327.43 | Calculated Property |
| η | 0.0002986 | Pa×s | 351.62 | Calculated Property |
| η | 0.0002413 | Pa×s | 375.81 | Calculated Property |
| η | 0.0001986 | Pa×s | 400.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [44.83; 0.00] | kJ/mol | [182.28; 576.50] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A·(1 − Tr)^(B + C·Tr + D·Tr² + E·Tr³), Tr = T/Tc Y is ΔvapH in kJ/mol, T in K | |||
| Coefficient A | 6.37750e+01 | |||
| Coefficient B | 1.51940e+00 | |||
| Coefficient C | -2.45690e+00 | |||
| Coefficient D | 2.06870e+00 | |||
| Coefficient E | -6.93750e-01 | |||
| Critical temperature, Tc (K) | 5.76500e+02 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 576.50 | |||
| ΔvapH | 44.83 | kJ/mol | 182.28 | Calculated Property |
| ΔvapH | 42.14 | kJ/mol | 226.08 | Calculated Property |
| ΔvapH | 39.68 | kJ/mol | 269.88 | Calculated Property |
| ΔvapH | 37.29 | kJ/mol | 313.69 | Calculated Property |
| ΔvapH | 34.80 | kJ/mol | 357.49 | Calculated Property |
| ΔvapH | 32.06 | kJ/mol | 401.29 | Calculated Property |
| ΔvapH | 28.85 | kJ/mol | 445.09 | Calculated Property |
| ΔvapH | 24.84 | kJ/mol | 488.90 | Calculated Property |
| ΔvapH | 19.08 | kJ/mol | 532.70 | Calculated Property |
| ΔvapH | 0.00 | kJ/mol | 576.50 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [282.74; 418.63] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.42156e+01 | |||
| Coefficient B | -3.35442e+03 | |||
| Coefficient C | -4.19010e+01 | |||
| Temperature range, min. | 282.74 | |||
| Temperature range, max. | 418.63 | |||
| Pvap | 1.33 | kPa | 282.74 | Calculated Property |
| Pvap | 3.03 | kPa | 297.84 | Calculated Property |
| Pvap | 6.29 | kPa | 312.94 | Calculated Property |
| Pvap | 12.09 | kPa | 328.04 | Calculated Property |
| Pvap | 21.76 | kPa | 343.14 | Calculated Property |
| Pvap | 37.02 | kPa | 358.23 | Calculated Property |
| Pvap | 60.02 | kPa | 373.33 | Calculated Property |
| Pvap | 93.28 | kPa | 388.43 | Calculated Property |
| Pvap | 139.74 | kPa | 403.53 | Calculated Property |
| Pvap | 202.66 | kPa | 418.63 | Calculated Property |
| Pvap | [6.27e-05; 2795.70] | kPa | [182.28; 576.50] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is Pvap in kPa, T in K | |||
| Coefficient A | 7.88689e+01 | |||
| Coefficient B | -7.09792e+03 | |||
| Coefficient C | -9.57222e+00 | |||
| Coefficient D | 6.70781e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 576.50 | |||
| Pvap | 6.27e-05 | kPa | 182.28 | Calculated Property |
| Pvap | 0.02 | kPa | 226.08 | Calculated Property |
| Pvap | 0.59 | kPa | 269.88 | Calculated Property |
| Pvap | 6.53 | kPa | 313.69 | Calculated Property |
| Pvap | 36.42 | kPa | 357.49 | Calculated Property |
| Pvap | 131.49 | kPa | 401.29 | Calculated Property |
| Pvap | 356.61 | kPa | 445.09 | Calculated Property |
| Pvap | 797.39 | kPa | 488.90 | Calculated Property |
| Pvap | 1562.36 | kPa | 532.70 | Calculated Property |
| Pvap | 2795.70 | kPa | 576.50 | Calculated Property |
| Pvap | [6.27e-05; 2791.95] | kPa | [182.28; 576.50] |
KDB Vapor Pressure Data
|
| Equation | ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K | |||
| Coefficient A | 7.90694e+01 | |||
| Coefficient B | -7.10610e+03 | |||
| Coefficient C | -9.60229e+00 | |||
| Coefficient D | 6.71857e-06 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 576.50 | |||
| Pvap | 6.27e-05 | kPa | 182.28 | Calculated Property |
| Pvap | 0.02 | kPa | 226.08 | Calculated Property |
| Pvap | 0.59 | kPa | 269.88 | Calculated Property |
| Pvap | 6.55 | kPa | 313.69 | Calculated Property |
| Pvap | 36.50 | kPa | 357.49 | Calculated Property |
| Pvap | 131.69 | kPa | 401.29 | Calculated Property |
| Pvap | 356.90 | kPa | 445.09 | Calculated Property |
| Pvap | 797.45 | kPa | 488.90 | Calculated Property |
| Pvap | 1561.34 | kPa | 532.70 | Calculated Property |
| Pvap | 2791.95 | kPa | 576.50 | Calculated Property |
| Pvap | [0.13; 101.68] | kPa | [249.30; 391.50] |
NIST
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.39264e+01 | |||
| Coefficient B | -3.17787e+03 | |||
| Coefficient C | -4.99630e+01 | |||
| Reference | Stull, 1947 | |||
| Comment | Coefficents calculated by NIST from author's data. | |||
| Temperature range, min. | 249.30 | |||
| Temperature range, max. | 391.50 | |||
| Pvap | 0.13 | kPa | 249.30 | Calculated Property |
| Pvap | 0.43 | kPa | 265.10 | Calculated Property |
| Pvap | 1.18 | kPa | 280.90 | Calculated Property |
| Pvap | 2.85 | kPa | 296.70 | Calculated Property |
| Pvap | 6.18 | kPa | 312.50 | Calculated Property |
| Pvap | 12.29 | kPa | 328.30 | Calculated Property |
| Pvap | 22.70 | kPa | 344.10 | Calculated Property |
| Pvap | 39.38 | kPa | 359.90 | Calculated Property |
| Pvap | 64.75 | kPa | 375.70 | Calculated Property |
| Pvap | 101.68 | kPa | 391.50 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ρl | [807.11; 251.00] | kg/m3 | [182.28; 576.50] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A / B^(1 + (1 − T/C)^D) Y is ρl in kg/m3, T in K | |||
| Coefficient A | 6.84046e+01 | |||
| Coefficient B | 2.72530e-01 | |||
| Coefficient C | 5.76500e+02 | |||
| Coefficient D | 2.81690e-01 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 576.50 | |||
| ρl | 807.11 | kg/m3 | 182.28 | Calculated Property |
| ρl | 776.93 | kg/m3 | 226.08 | Calculated Property |
| ρl | 745.19 | kg/m3 | 269.88 | Calculated Property |
| ρl | 711.51 | kg/m3 | 313.69 | Calculated Property |
| ρl | 675.35 | kg/m3 | 357.49 | Calculated Property |
| ρl | 635.83 | kg/m3 | 401.29 | Calculated Property |
| ρl | 591.45 | kg/m3 | 445.09 | Calculated Property |
| ρl | 539.19 | kg/m3 | 488.90 | Calculated Property |
| ρl | 470.81 | kg/m3 | 532.70 | Calculated Property |
| ρl | 251.00 | kg/m3 | 576.50 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| γ | [0.03; 7.81e-06] | N/m | [182.28; 573.74] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is γ in N/m, T in K | |||
| Coefficient A | -1.05360e-02 | |||
| Coefficient B | 3.94640e+01 | |||
| Coefficient C | -3.29830e+00 | |||
| Coefficient D | 5.83270e-04 | |||
| Coefficient E | -5.03480e-06 | |||
| Comment | Range stopped where the equation turns negative; ChemSep gives it to 576.5 K. | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 573.74 | |||
| γ | 0.03 | N/m | 182.28 | Calculated Property |
| γ | 0.03 | N/m | 225.78 | Calculated Property |
| γ | 0.02 | N/m | 269.27 | Calculated Property |
| γ | 0.02 | N/m | 312.77 | Calculated Property |
| γ | 0.02 | N/m | 356.26 | Calculated Property |
| γ | 0.01 | N/m | 399.76 | Calculated Property |
| γ | 0.01 | N/m | 443.25 | Calculated Property |
| γ | 0.01 | N/m | 486.75 | Calculated Property |
| γ | 0.00 | N/m | 530.24 | Calculated Property |
| γ | 7.81e-06 | N/m | 573.74 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λgas | [0.00; 0.10] | W/m×K | [182.28; 1000.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A·T^B / (1 + C/T + D/T²) Y is λgas in W/m×K, T in K | |||
| Coefficient A | 2.17730e-05 | |||
| Coefficient B | 1.21970e+00 | |||
| Coefficient C | -1.36640e+02 | |||
| Coefficient D | 1.38470e+05 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 1000.00 | |||
| λgas | 0.00 | W/m×K | 182.28 | Calculated Property |
| λgas | 0.01 | W/m×K | 273.14 | Calculated Property |
| λgas | 0.02 | W/m×K | 364.00 | Calculated Property |
| λgas | 0.03 | W/m×K | 454.85 | Calculated Property |
| λgas | 0.04 | W/m×K | 545.71 | Calculated Property |
| λgas | 0.05 | W/m×K | 636.57 | Calculated Property |
| λgas | 0.06 | W/m×K | 727.43 | Calculated Property |
| λgas | 0.07 | W/m×K | 818.28 | Calculated Property |
| λgas | 0.09 | W/m×K | 909.14 | Calculated Property |
| λgas | 0.10 | W/m×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λliquid | [0.13; 0.09] | W/m×K | [182.28; 391.42] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is λliquid in W/m×K, T in K | |||
| Coefficient A | -3.74270e-02 | |||
| Coefficient B | 7.77850e+00 | |||
| Coefficient C | -1.71610e+00 | |||
| Coefficient D | -2.83170e-04 | |||
| Coefficient E | -1.77280e-06 | |||
| Temperature range, min. | 182.28 | |||
| Temperature range, max. | 391.42 | |||
| λliquid | 0.13 | W/m×K | 182.28 | Calculated Property |
| λliquid | 0.13 | W/m×K | 205.52 | Calculated Property |
| λliquid | 0.12 | W/m×K | 228.76 | Calculated Property |
| λliquid | 0.12 | W/m×K | 251.99 | Calculated Property |
| λliquid | 0.11 | W/m×K | 275.23 | Calculated Property |
| λliquid | 0.11 | W/m×K | 298.47 | Calculated Property |
| λliquid | 0.10 | W/m×K | 321.71 | Calculated Property |
| λliquid | 0.10 | W/m×K | 344.94 | Calculated Property |
| λliquid | 0.09 | W/m×K | 368.18 | Calculated Property |
| λliquid | 0.09 | W/m×K | 391.42 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentane, 3-ethyl-3-methyl-.
Sources
- KDB Vapor Pressure Data
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 5 ChEDL chemicals 1.5.2, from Daubert, T. E. Vapor-Liquid Critical Properties of Elements and Compounds. 5. Branched Alkanes and Cycloalkanes. J. Chem. Eng. Data 1996, 41, 365-372.
- Passut and Danner (1973), critical constants and acentric factors ChEDL chemicals 1.5.2, from Passut, C. A.; Danner, R. P. Acentric Factor. A Valuable Correlating Parameter for the Properties of Hydrocarbons. Ind. Eng. Chem. Process Des. Dev. 1973, 12, 365-368.
- PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
- Cheméo Relay (1.0)
- ChemSep v8.3 pure component data Converted from ChemSep v8.3 pure component data, H. Kooijman and R. Taylor (2021, 2022), Artistic License 2.0; see how the values differ.
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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