- InChI
- InChI=1S/C8H8O/c1-2-4-7(5-3-1)8-6-9-8/h1-5,8H,6H2
- InChI Key
- AWMVMTVKBNGEAK-UHFFFAOYSA-N
- Formula
- C8H8O
- SMILES
- c1ccc(C2CO2)cc1
- Molecular Weight1
- 120.15
- CAS
- 96-09-3
- Other Names
-
- (.+/-.)-Styrene oxide
- (1,2-Epoxyethyl)benzene
- (Epoxyethyl)benzene
- 1,2-Epoxy-1-phenylethane
- 1-Phenyl-1,2-epoxyethane
- 1-Phenyloxirane
- 2-Phenyloxirane
- Benzene, (epoxyethyl)-
- Benzene, epoxymethyl-
- Epoxystyrene
- Ethane, 1,2-epoxy-1-phenyl-
- Fenyloxiran
- NCI-C54977
- NSC 637
- Oxirane, 2-phenyl-
- Phenethylene oxide
- Phenylethylene oxide
- Phenyloxirane
- Styrene 7,8-oxide
- Styrene epoxide
- Styrene oxide
- Styryl oxide
- «alpha»,«beta»-Epoxystyrene
- «alpha»,«beta»-Epoxystyrene
- 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° | 103.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -31.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.10 | kJ/mol | Joback Calculated Property |
| IE | [9.04; 9.23] | eV |
|
| IE | 9.23 | eV | NIST |
| IE | 9.04 | eV | NIST |
| IE | 9.07 | eV | NIST |
| log10WS | [-1.60; -1.60] |
|
|
| log10WS | -1.60 | Aq. Sol... | |
| log10WS | -1.60 | Estimat... | |
| logPoct/wat | 1.758 | Crippen Calculated Property | |
| McVol | 94.830 | ml/mol | McGowan Calculated Property |
| Pc | 4249.61 | kPa | Joback Calculated Property |
| Inp | [1119.00; 1119.00] |
|
|
| Inp | 1119.00 | NIST | |
| Inp | 1119.00 | NIST | |
| I | [1628.90; 1630.80] |
|
|
| I | 1630.80 | NIST | |
| I | 1628.90 | NIST | |
| Tboil | [467.25; 467.30] | K |
|
| Tboil | 467.30 | K | NIST |
| Tboil | 467.25 | K | NIST |
| Tc | 670.29 | K | Joback Calculated Property |
| Tfus | [236.35; 236.85] | K |
|
| Tfus | 236.85 | K | Aq. Sol... |
| Tfus | 236.35 | K | NIST |
| Vc | 0.353 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [187.70; 255.73] | J/mol×K | [442.81; 670.29] |
|
| Cp,gas | 187.70 | J/mol×K | 442.81 | Joback Calculated Property |
| Cp,gas | 201.41 | J/mol×K | 480.72 | Joback Calculated Property |
| Cp,gas | 214.08 | J/mol×K | 518.64 | Joback Calculated Property |
| Cp,gas | 225.78 | J/mol×K | 556.55 | Joback Calculated Property |
| Cp,gas | 236.58 | J/mol×K | 594.46 | Joback Calculated Property |
| Cp,gas | 246.54 | J/mol×K | 632.38 | Joback Calculated Property |
| Cp,gas | 255.73 | J/mol×K | 670.29 | Joback Calculated Property |
| η | [0.0004591; 0.0018556] | Pa×s | [250.85; 442.81] |
|
| η | 0.0018556 | Pa×s | 250.85 | Joback Calculated Property |
| η | 0.0012889 | Pa×s | 282.84 | Joback Calculated Property |
| η | 0.0009641 | Pa×s | 314.84 | Joback Calculated Property |
| η | 0.0007608 | Pa×s | 346.83 | Joback Calculated Property |
| η | 0.0006249 | Pa×s | 378.82 | Joback Calculated Property |
| η | 0.0005293 | Pa×s | 410.82 | Joback Calculated Property |
| η | 0.0004591 | Pa×s | 442.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Oxirane, phenyl-.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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