- InChI
- InChI=1S/C10H12/c1-2-3-7-10-8-5-4-6-9-10/h2,4-6,8-9H,1,3,7H2
- InChI Key
- PBGVMIDTGGTBFS-UHFFFAOYSA-N
- Formula
- C10H12
- SMILES
- C=CCCc1ccccc1
- Molecular Weight1
- 132.20
- CAS
- 768-56-9
- Other Names
-
- 1-Butene, 4-phenyl-
- 1-Phenyl-3-butene
- 3-Butenylbenzene
- 4-Phenyl-1-butene
- 4-Phenylbut-1-ene
- 4-Phenylbutene-1
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔcH°liquid | -5683.50 | kJ/mol | NIST |
| ΔfG° | 233.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 112.23 | kJ/mol | Joback Calculated Property |
| ΔfH°liquid | [7.90; 33.40] | kJ/mol |
|
| ΔfH°liquid | 33.40 ± 5.00 | kJ/mol | NIST |
| ΔfH°liquid | 7.90 | kJ/mol | NIST |
| ΔfusH° | 14.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.46 | kJ/mol | Joback Calculated Property |
| IE | [8.60; 8.83] | eV |
|
| IE | 8.60 | eV | NIST |
| IE | 8.60 | eV | NIST |
| IE | 8.83 | eV | NIST |
| log10WS | -2.97 | Crippen Calculated Property | |
| logPoct/wat | 2.805 | Crippen Calculated Property | |
| McVol | 123.700 | ml/mol | McGowan Calculated Property |
| Pc | 3069.34 | kPa | Joback Calculated Property |
| Inp | [1022.00; 1032.00] |
|
|
| Inp | 1032.00 | NIST | |
| Inp | 1022.00 | NIST | |
| Inp | 1032.00 | NIST | |
| Tboil | [448.15; 454.70] | K |
|
| Tboil | 450.20 | K | NIST |
| Tboil | 452.00 ± 3.00 | K | NIST |
| Tboil | 454.25 ± 0.50 | K | NIST |
| Tboil | 454.70 ± 0.50 | K | NIST |
| Tboil | 450.15 ± 2.00 | K | NIST |
| Tboil | 448.15 ± 6.00 | K | NIST |
| Tboil | 449.15 ± 2.00 | K | NIST |
| Tc | 660.72 | K | Joback Calculated Property |
| Tfus | 227.12 | K | Joback Calculated Property |
| Vc | 0.469 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [239.71; 314.51] | J/mol×K | [451.56; 660.72] |
|
| Cp,gas | 239.71 | J/mol×K | 451.56 | Joback Calculated Property |
| Cp,gas | 254.20 | J/mol×K | 486.42 | Joback Calculated Property |
| Cp,gas | 267.83 | J/mol×K | 521.28 | Joback Calculated Property |
| Cp,gas | 280.64 | J/mol×K | 556.14 | Joback Calculated Property |
| Cp,gas | 292.66 | J/mol×K | 591.00 | Joback Calculated Property |
| Cp,gas | 303.94 | J/mol×K | 625.86 | Joback Calculated Property |
| Cp,gas | 314.51 | J/mol×K | 660.72 | Joback Calculated Property |
| η | [0.0002266; 0.0032741] | Pa×s | [227.12; 451.56] |
|
| η | 0.0032741 | Pa×s | 227.12 | Joback Calculated Property |
| η | 0.0015315 | Pa×s | 264.53 | Joback Calculated Property |
| η | 0.0008648 | Pa×s | 301.93 | Joback Calculated Property |
| η | 0.0005539 | Pa×s | 339.34 | Joback Calculated Property |
| η | 0.0003876 | Pa×s | 376.75 | Joback Calculated Property |
| η | 0.0002893 | Pa×s | 414.15 | Joback Calculated Property |
| η | 0.0002266 | Pa×s | 451.56 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 337.20 | K | 1.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [332.12; 480.66] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.43023e+01 | |||
| Coefficient B | -3.72551e+03 | |||
| Coefficient C | -6.62920e+01 | |||
| Temperature range, min. | 332.12 | |||
| Temperature range, max. | 480.66 | |||
| Pvap | 1.33 | kPa | 332.12 | Calculated Property |
| Pvap | 3.02 | kPa | 348.62 | Calculated Property |
| Pvap | 6.27 | kPa | 365.13 | Calculated Property |
| Pvap | 12.04 | kPa | 381.63 | Calculated Property |
| Pvap | 21.66 | kPa | 398.14 | Calculated Property |
| Pvap | 36.88 | kPa | 414.64 | Calculated Property |
| Pvap | 59.82 | kPa | 431.15 | Calculated Property |
| Pvap | 93.06 | kPa | 447.65 | Calculated Property |
| Pvap | 139.56 | kPa | 464.16 | Calculated Property |
| Pvap | 202.65 | kPa | 480.66 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 3-butenyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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