- InChI
- InChI=1S/C16H16/c1-14(16-10-6-3-7-11-16)12-13-15-8-4-2-5-9-15/h2-14H,1H3/b13-12+
- InChI Key
- GNQWHYWLSGTMSL-OUKQBFOZSA-N
- Formula
- C16H16
- SMILES
- CC(C=Cc1ccccc1)c1ccccc1
- Molecular Weight1
- 208.30
- CAS
- 7614-93-9
- Other Names
-
- 1,3-Diphenyl-1-butene
- 1,3-Diphenylbutene-1
- 1-Butene, 1,3-diphenyl-
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 386.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 211.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.33 | kJ/mol | Joback Calculated Property |
| log10WS | -4.71 | Crippen Calculated Property | |
| logPoct/wat | 4.503 | Crippen Calculated Property | |
| McVol | 184.480 | ml/mol | McGowan Calculated Property |
| Pc | 2421.88 | kPa | Joback Calculated Property |
| Inp | 1740.00 | NIST | |
| Tboil | 622.56 | K | Joback Calculated Property |
| Tc | 868.04 | K | Joback Calculated Property |
| Tfus | 302.84 | K | Joback Calculated Property |
| Vc | 0.690 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [452.06; 543.67] | J/mol×K | [622.56; 868.04] | 
|
| Cp,gas | 452.06 | J/mol×K | 622.56 | Joback Calculated Property |
| Cp,gas | 470.67 | J/mol×K | 663.47 | Joback Calculated Property |
| Cp,gas | 487.79 | J/mol×K | 704.39 | Joback Calculated Property |
| Cp,gas | 503.54 | J/mol×K | 745.30 | Joback Calculated Property |
| Cp,gas | 518.02 | J/mol×K | 786.21 | Joback Calculated Property |
| Cp,gas | 531.36 | J/mol×K | 827.13 | Joback Calculated Property |
| Cp,gas | 543.67 | J/mol×K | 868.04 | Joback Calculated Property |
| η | [0.0001202; 0.0030034] | Pa×s | [302.84; 622.56] |
|
| η | 0.0030034 | Pa×s | 302.84 | Joback Calculated Property |
| η | 0.0011759 | Pa×s | 356.13 | Joback Calculated Property |
| η | 0.0005877 | Pa×s | 409.41 | Joback Calculated Property |
| η | 0.0003446 | Pa×s | 462.70 | Joback Calculated Property |
| η | 0.0002256 | Pa×s | 515.99 | Joback Calculated Property |
| η | 0.0001599 | Pa×s | 569.27 | Joback Calculated Property |
| η | 0.0001202 | Pa×s | 622.56 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [435.32; 616.63] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.45046e+01 | |||
| Coefficient B | -4.71686e+03 | |||
| Coefficient C | -1.03544e+02 | |||
| Temperature range, min. | 435.32 | |||
| Temperature range, max. | 616.63 | |||
| Pvap | 1.33 | kPa | 435.32 | Calculated Property |
| Pvap | 3.01 | kPa | 455.47 | Calculated Property |
| Pvap | 6.22 | kPa | 475.61 | Calculated Property |
| Pvap | 11.92 | kPa | 495.76 | Calculated Property |
| Pvap | 21.45 | kPa | 515.90 | Calculated Property |
| Pvap | 36.55 | kPa | 536.05 | Calculated Property |
| Pvap | 59.38 | kPa | 556.19 | Calculated Property |
| Pvap | 92.58 | kPa | 576.34 | Calculated Property |
| Pvap | 139.18 | kPa | 596.48 | Calculated Property |
| Pvap | 202.65 | kPa | 616.63 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,1'-(3-methyl-1-propene-1,3-diyl)bis-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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