- InChI
- InChI=1S/C11H14/c1-2-9-6-7-10-4-3-5-11(10)8-9/h6-8H,2-5H2,1H3
- InChI Key
- IFKCGHPIWWIUOG-UHFFFAOYSA-N
- Formula
- C11H14
- SMILES
- CCc1ccc2c(c1)CCC2
- Molecular Weight1
- 146.23
- 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.
- 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 | 0.4182 | Relay (1.0) Calculated Property | |
| ΔfG° | 203.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 3.44 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.29 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.738 | Crippen Calculated Property | |
| McVol | 131.230 | ml/mol | McGowan Calculated Property |
| Pc | 3052.41 | kPa | Joback Calculated Property |
| Inp | [1206.07; 1243.34] |
|
|
| Inp | 1206.07 | NIST | |
| Inp | 1212.73 | NIST | |
| Inp | 1217.04 | NIST | |
| Inp | 1231.25 | NIST | |
| Inp | 1238.62 | NIST | |
| Inp | 1243.34 | NIST | |
| Tboil | 498.01 | K | Relay (1.0) Calculated Property |
| Tc | 721.75 | K | Relay (1.0) Calculated Property |
| Tfus | 223.74 | K | Relay (1.0) Calculated Property |
| Vc | 0.507 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [160.97; 435.30] | 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 | -6.85990e+01 | |||
| Coefficient B | 1.02832e+00 | |||
| Coefficient C | -7.47320e-04 | |||
| Coefficient D | 2.22900e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 160.97 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 211.53 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 255.43 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 293.37 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 326.05 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 354.18 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 378.47 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 399.61 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 418.32 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 435.30 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0016819; 0.0003712] | Pa×s | [287.37; 504.44] |
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 | -9.89880e+00 | |||
| Coefficient B | 1.00895e+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. | 287.37 | |||
| Temperature range, max. | 504.44 | |||
| η | 0.0016819 | Pa×s | 287.37 | Calculated Property |
| η | 0.0012816 | Pa×s | 311.49 | Calculated Property |
| η | 0.0010154 | Pa×s | 335.61 | Calculated Property |
| η | 0.0008300 | Pa×s | 359.73 | Calculated Property |
| η | 0.0006959 | Pa×s | 383.85 | Calculated Property |
| η | 0.0005958 | Pa×s | 407.97 | Calculated Property |
| η | 0.0005189 | Pa×s | 432.09 | Calculated Property |
| η | 0.0004587 | Pa×s | 456.21 | Calculated Property |
| η | 0.0004105 | Pa×s | 480.33 | Calculated Property |
| η | 0.0003712 | Pa×s | 504.44 | Calculated Property |
Similar Compounds
Find more compounds similar to 5-Ethylindan.
Sources
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