- InChI
- InChI=1S/C11H14/c1-4-10-6-5-7-11(8-10)9(2)3/h4-9H,1H2,2-3H3
- InChI Key
- BYYLJVQCWRRFMP-UHFFFAOYSA-N
- Formula
- C11H14
- SMILES
- C=Cc1cccc(C(C)C)c1
- Molecular Weight1
- 146.23
- Other Names
-
- 1-Vinyl-3-isopropylbenzene
- 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 | 0.3564 | Relay (1.0) Calculated Property | |
| ΔfG° | 229.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 65.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.453 | Crippen Calculated Property | |
| McVol | 137.790 | ml/mol | McGowan Calculated Property |
| Pc | 2746.90 | kPa | Joback Calculated Property |
| Inp | [1117.40; 1117.40] |
|
|
| Inp | 1117.40 | NIST | |
| Inp | 1117.40 | NIST | |
| Tboil | 473.00 | K | Relay (1.0) Calculated Property |
| Tc | 689.13 | K | Relay (1.0) Calculated Property |
| Tfus | 208.99 | K | Relay (1.0) Calculated Property |
| Vc | 0.499 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [174.00; 437.29] | 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 | -3.13900e+01 | |||
| Coefficient B | 8.96340e-01 | |||
| Coefficient C | -5.64860e-04 | |||
| Coefficient D | 1.37200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 174.00 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 221.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 262.71 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 299.29 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 331.27 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 359.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 383.15 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 403.92 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 421.82 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 437.29 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0032866; 0.0001943] | Pa×s | [235.91; 484.24] |
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 | -1.12328e+01 | |||
| Coefficient B | 1.30102e+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. | 235.91 | |||
| Temperature range, max. | 484.24 | |||
| η | 0.0032866 | Pa×s | 235.91 | Calculated Property |
| η | 0.0018448 | Pa×s | 263.50 | Calculated Property |
| η | 0.0011553 | Pa×s | 291.09 | Calculated Property |
| η | 0.0007846 | Pa×s | 318.69 | Calculated Property |
| η | 0.0005667 | Pa×s | 346.28 | Calculated Property |
| η | 0.0004295 | Pa×s | 373.87 | Calculated Property |
| η | 0.0003381 | Pa×s | 401.46 | Calculated Property |
| η | 0.0002745 | Pa×s | 429.05 | Calculated Property |
| η | 0.0002286 | Pa×s | 456.64 | Calculated Property |
| η | 0.0001943 | Pa×s | 484.24 | Calculated Property |
Similar Compounds
Find more compounds similar to 3-isopropyl styrene.
Sources
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