- InChI
- InChI=1S/C12H26/c1-4-7-10-12(9-6-3)11-8-5-2/h12H,4-11H2,1-3H3
- InChI Key
- ISHSSTRAYNPQFX-UHFFFAOYSA-N
- Formula
- C12H26
- SMILES
- CCCCC(CCC)CCCC
- Molecular Weight1
- 170.33
- CAS
- 998-35-6
- Other Names
-
- 5-Propyl-nonane
- 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).
- 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 | 0.5190 | Relay (1.0) Calculated Property | |
| ΔfG° | 47.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -285.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.32 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.783 | Crippen Calculated Property | |
| McVol | 179.940 | ml/mol | McGowan Calculated Property |
| Pc | 1792.42 | kPa | Joback Calculated Property |
| Tboil | 473.38 | K | Relay (1.0) Calculated Property |
| Tc | 641.97 | K | Relay (1.0) Calculated Property |
| Tfus | 192.20 | K | Relay (1.0) Calculated Property |
| Vc | 0.671 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [259.73; 638.96] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -9.70200e+00 | |||
| Coefficient B | 1.14976e+00 | |||
| Coefficient C | -6.32200e-04 | |||
| Coefficient D | 1.31100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 259.73 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 323.74 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 381.31 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 432.86 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 478.80 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 519.56 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 555.53 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 587.15 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 614.82 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 638.96 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0101808; 0.0002445] | Pa×s | [210.00; 446.61] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.16262e+01 | |||
| Coefficient B | 1.47818e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 210.00 | |||
| Temperature range, max. | 446.61 | |||
| η | 0.0101808 | Pa×s | 210.00 | Calculated Property |
| η | 0.0046522 | Pa×s | 236.29 | Calculated Property |
| η | 0.0024868 | Pa×s | 262.58 | Calculated Property |
| η | 0.0014899 | Pa×s | 288.87 | Calculated Property |
| η | 0.0009722 | Pa×s | 315.16 | Calculated Property |
| η | 0.0006775 | Pa×s | 341.45 | Calculated Property |
| η | 0.0004972 | Pa×s | 367.74 | Calculated Property |
| η | 0.0003802 | Pa×s | 394.03 | Calculated Property |
| η | 0.0003007 | Pa×s | 420.32 | Calculated Property |
| η | 0.0002445 | Pa×s | 446.61 | Calculated Property |
Similar Compounds
Find more compounds similar to Nonane, 5-propyl-.
Sources
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