- InChI
- InChI=1S/C15H24/c1-3-4-5-7-10-14(2)13-15-11-8-6-9-12-15/h6,8-9,11-12,14H,3-5,7,10,13H2,1-2H3
- InChI Key
- LNCYHRXIFYLQPO-UHFFFAOYSA-N
- Formula
- C15H24
- SMILES
- CCCCCCC(C)Cc1ccccc1
- Molecular Weight1
- 204.36
- Other Names
-
- (2-methyloctyl)benzene
- 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 | 0.5575 | Relay (1.0) Calculated Property | |
| ΔfG° | 185.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -116.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.836 | Crippen Calculated Property | |
| McVol | 198.450 | ml/mol | McGowan Calculated Property |
| Pc | 1859.51 | kPa | Joback Calculated Property |
| Tboil | 541.93 | K | Relay (1.0) Calculated Property |
| Tc | 730.15 | K | Relay (1.0) Calculated Property |
| Tfus | 229.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.743 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [266.12; 675.21] | 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 | -4.63340e+01 | |||
| Coefficient B | 1.35584e+00 | |||
| Coefficient C | -8.26600e-04 | |||
| Coefficient D | 1.92300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 266.12 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 338.39 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 402.54 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 459.17 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 508.90 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 552.33 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 590.06 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 622.72 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 650.89 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 675.21 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0050617; 0.0001892] | Pa×s | [270.23; 535.14] |
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 | -1.19251e+01 | |||
| Coefficient B | 1.79408e+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. | 270.23 | |||
| Temperature range, max. | 535.14 | |||
| η | 0.0050617 | Pa×s | 270.23 | Calculated Property |
| η | 0.0026368 | Pa×s | 299.66 | Calculated Property |
| η | 0.0015436 | Pa×s | 329.10 | Calculated Property |
| η | 0.0009866 | Pa×s | 358.53 | Calculated Property |
| η | 0.0006750 | Pa×s | 387.97 | Calculated Property |
| η | 0.0004871 | Pa×s | 417.40 | Calculated Property |
| η | 0.0003670 | Pa×s | 446.84 | Calculated Property |
| η | 0.0002864 | Pa×s | 476.27 | Calculated Property |
| η | 0.0002300 | Pa×s | 505.71 | Calculated Property |
| η | 0.0001892 | Pa×s | 535.14 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (2-methyloctyl)-.
Sources
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