- InChI
- InChI=1S/C17H28/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h9,11-12,14-16H,3-8,10,13H2,1-2H3
- InChI Key
- YHJBCRBYDBNEIK-UHFFFAOYSA-N
- Formula
- C17H28
- SMILES
- CCCCCCCCCC(C)c1ccccc1
- Molecular Weight1
- 232.41
- Other Names
-
- Undecane, 2-phenyl-
- 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).
- Inp : Non-polar retention indices.
- Ip : 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 | 0.6343 | Relay (1.0) Calculated Property | |
| ΔfG° | 202.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -159.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.78 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.931 | Crippen Calculated Property | |
| McVol | 226.630 | ml/mol | McGowan Calculated Property |
| Pc | 1586.01 | kPa | Joback Calculated Property |
| Inp | [289.00; 1715.00] |
|
|
| Inp | 1696.00 | NIST | |
| Inp | 1715.00 | NIST | |
| Inp | 1692.00 | NIST | |
| Inp | 289.00 | NIST | |
| Inp | 1696.00 | NIST | |
| Ip | 1933.00 | NIST | |
| Tboil | 565.74 | K | Relay (1.0) Calculated Property |
| Tc | 759.80 | K | Relay (1.0) Calculated Property |
| Tfus | 281.30 ± 2.00 | K | NIST |
| Vc | 0.861 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [308.54; 778.39] | 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 | -4.81520e+01 | |||
| Coefficient B | 1.54584e+00 | |||
| Coefficient C | -9.35400e-04 | |||
| Coefficient D | 2.16100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 308.54 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 391.23 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 464.70 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 529.63 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 586.72 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 636.65 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 680.10 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 717.75 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 750.28 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 778.39 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0058156; 0.0001702] | Pa×s | [281.30; 563.84] |
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 | -1.21945e+01 | |||
| Coefficient B | 1.98240e+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. | 281.30 | |||
| Temperature range, max. | 563.84 | |||
| η | 0.0058156 | Pa×s | 281.30 | Calculated Property |
| η | 0.0028663 | Pa×s | 312.69 | Calculated Property |
| η | 0.0016073 | Pa×s | 344.09 | Calculated Property |
| η | 0.0009929 | Pa×s | 375.48 | Calculated Property |
| η | 0.0006607 | Pa×s | 406.88 | Calculated Property |
| η | 0.0004660 | Pa×s | 438.27 | Calculated Property |
| η | 0.0003444 | Pa×s | 469.66 | Calculated Property |
| η | 0.0002644 | Pa×s | 501.06 | Calculated Property |
| η | 0.0002094 | Pa×s | 532.45 | Calculated Property |
| η | 0.0001702 | Pa×s | 563.84 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (1-methyldecyl)-.
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