- InChI
- InChI=1S/C10H10/c1-2-3-7-10-8-5-4-6-9-10/h2-9H,1H2
- InChI Key
- XZKRXPZXQLARHH-UHFFFAOYSA-N
- Formula
- C10H10
- SMILES
- C=CC=Cc1ccccc1
- Molecular Weight1
- 130.19
- CAS
- 1515-78-2
- Other Names
-
- 1,3-Butadiene, 1-phenyl-
- 1-Phenylbutadiene
- 1-Phenyl-1,3-butadiene
- 1,3-Butadienylbenzene
- 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.
- I : 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° | 313.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 229.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.42 | kJ/mol | Joback Calculated Property |
| IE | 8.39 | eV | NIST |
| log10WS | -2.99 | Crippen Calculated Property | |
| logPoct/wat | 2.886 | Crippen Calculated Property | |
| McVol | 119.400 | ml/mol | McGowan Calculated Property |
| Pc | 3254.14 | kPa | Joback Calculated Property |
| Inp | [177.00; 1150.00] |
|
|
| Inp | 1150.00 | NIST | |
| Inp | 177.00 | NIST | |
| I | 1572.00 | NIST | |
| Tboil | 455.72 | K | Joback Calculated Property |
| Tc | 675.61 | K | Joback Calculated Property |
| Tfus | 222.04 | K | Joback Calculated Property |
| Vc | 0.449 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.50; 294.51] | J/mol×K | [455.72; 675.61] |
|
| Cp,gas | 223.50 | J/mol×K | 455.72 | Joback Calculated Property |
| Cp,gas | 237.60 | J/mol×K | 492.37 | Joback Calculated Property |
| Cp,gas | 250.71 | J/mol×K | 529.02 | Joback Calculated Property |
| Cp,gas | 262.90 | J/mol×K | 565.67 | Joback Calculated Property |
| Cp,gas | 274.22 | J/mol×K | 602.32 | Joback Calculated Property |
| Cp,gas | 284.74 | J/mol×K | 638.97 | Joback Calculated Property |
| Cp,gas | 294.51 | J/mol×K | 675.61 | Joback Calculated Property |
| η | [0.0001896; 0.0030060] | Pa×s | [222.04; 455.72] |
|
| η | 0.0030060 | Pa×s | 222.04 | Joback Calculated Property |
| η | 0.0013450 | Pa×s | 260.99 | Joback Calculated Property |
| η | 0.0007416 | Pa×s | 299.93 | Joback Calculated Property |
| η | 0.0004689 | Pa×s | 338.88 | Joback Calculated Property |
| η | 0.0003258 | Pa×s | 377.83 | Joback Calculated Property |
| η | 0.0002424 | Pa×s | 416.77 | Joback Calculated Property |
| η | 0.0001896 | Pa×s | 455.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,3-butadienyl-.
Sources
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