- InChI
- InChI=1S/C10H12O/c1-2-9(8-11)10-6-4-3-5-7-10/h3-9H,2H2,1H3
- InChI Key
- DIBSCKQIZZVKMG-UHFFFAOYSA-N
- Formula
- C10H12O
- SMILES
- CCC(C=O)c1ccccc1
- Molecular Weight1
- 148.21
- Other Names
-
- 2-phenylbutyraldehyde
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3840 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -94.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.64 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.379 | Crippen Calculated Property | |
| McVol | 129.570 | ml/mol | McGowan Calculated Property |
| Pc | 3210.04 | kPa | Joback Calculated Property |
| Tboil | 490.10 | K | Relay (1.0) Calculated Property |
| Tc | 714.49 | K | Relay (1.0) Calculated Property |
| Tfus | 278.35 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [277.96; 349.65] | J/mol×K | [503.10; 717.41] | 
|
| Cp,gas | 277.96 | J/mol×K | 503.10 | Joback Calculated Property |
| Cp,gas | 291.94 | J/mol×K | 538.82 | Joback Calculated Property |
| Cp,gas | 305.05 | J/mol×K | 574.54 | Joback Calculated Property |
| Cp,gas | 317.35 | J/mol×K | 610.25 | Joback Calculated Property |
| Cp,gas | 328.85 | J/mol×K | 645.97 | Joback Calculated Property |
| Cp,gas | 339.61 | J/mol×K | 681.69 | Joback Calculated Property |
| Cp,gas | 349.65 | J/mol×K | 717.41 | Joback Calculated Property |
| η | [0.0002659; 0.0048874] | Pa×s | [255.88; 503.10] |
|
| η | 0.0048874 | Pa×s | 255.88 | Joback Calculated Property |
| η | 0.0021490 | Pa×s | 297.08 | Joback Calculated Property |
| η | 0.0011543 | Pa×s | 338.29 | Joback Calculated Property |
| η | 0.0007096 | Pa×s | 379.49 | Joback Calculated Property |
| η | 0.0004798 | Pa×s | 420.69 | Joback Calculated Property |
| η | 0.0003479 | Pa×s | 461.90 | Joback Calculated Property |
| η | 0.0002659 | Pa×s | 503.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to BENZENEACETALDEHYDE, .ALPHA.-ETHYL-.
Sources
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