- InChI
- InChI=1S/C9H8O/c1-2-9(10)8-6-4-3-5-7-8/h2-7H,1H2
- InChI Key
- KUIZKZHDMPERHR-UHFFFAOYSA-N
- Formula
- C9H8O
- SMILES
- C=CC(=O)c1ccccc1
- Molecular Weight1
- 132.16
- CAS
- 768-03-6
- Other Names
-
- Acetophenone, 2-methylene-
- Acrylophenone
- Ethylene, benzoyl-
- Ketone, phenyl vinyl
- Phenyl vinyl ketone
- Vinyl phenyl ketone
- 2-Propenophenone
- 1-Phenyl-2-propen-1-one
- 3-Oxo-3-phenylpropene
- NSC 174109
- 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).
- 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° | 96.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 20.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.98 | kJ/mol | Joback Calculated Property |
| log10WS | -2.40 | Crippen Calculated Property | |
| logPoct/wat | 2.055 | Crippen Calculated Property | |
| McVol | 111.180 | ml/mol | McGowan Calculated Property |
| Pc | 3690.97 | kPa | Joback Calculated Property |
| Inp | [1138.00; 1147.00] |
|
|
| Inp | 1138.00 | NIST | |
| Inp | 1147.00 | NIST | |
| Tboil | 482.55 | K | Joback Calculated Property |
| Tc | 705.91 | K | Joback Calculated Property |
| Tfus | 265.78 | K | Joback Calculated Property |
| Vc | 0.418 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [216.22; 277.72] | J/mol×K | [482.55; 705.91] |
|
| Cp,gas | 216.22 | J/mol×K | 482.55 | Joback Calculated Property |
| Cp,gas | 228.41 | J/mol×K | 519.78 | Joback Calculated Property |
| Cp,gas | 239.77 | J/mol×K | 557.00 | Joback Calculated Property |
| Cp,gas | 250.34 | J/mol×K | 594.23 | Joback Calculated Property |
| Cp,gas | 260.16 | J/mol×K | 631.46 | Joback Calculated Property |
| Cp,gas | 269.27 | J/mol×K | 668.69 | Joback Calculated Property |
| Cp,gas | 277.72 | J/mol×K | 705.91 | Joback Calculated Property |
| η | [0.0002738; 0.0027848] | Pa×s | [265.78; 482.55] |
|
| η | 0.0027848 | Pa×s | 265.78 | Joback Calculated Property |
| η | 0.0015013 | Pa×s | 301.91 | Joback Calculated Property |
| η | 0.0009236 | Pa×s | 338.04 | Joback Calculated Property |
| η | 0.0006241 | Pa×s | 374.16 | Joback Calculated Property |
| η | 0.0004518 | Pa×s | 410.29 | Joback Calculated Property |
| η | 0.0003447 | Pa×s | 446.42 | Joback Calculated Property |
| η | 0.0002738 | Pa×s | 482.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propen-1-one, 1-phenyl-.
Sources
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