- InChI
- InChI=1S/C11H14O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
- InChI Key
- DGZJLMWKIQOQFA-UHFFFAOYSA-N
- Formula
- C11H14O
- SMILES
- CCC(C)C(=O)c1ccccc1
- Molecular Weight1
- 162.23
- Other Names
-
- «alpha»-Methylpropyl phenyl ketone
- ω : Acentric Factor.
- 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.
- 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 |
|---|---|---|---|
| ω | 0.4472 | Relay (1.0) Calculated Property | |
| ΔfG° | 22.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -164.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.915 | Crippen Calculated Property | |
| McVol | 143.660 | ml/mol | McGowan Calculated Property |
| Pc | 2853.57 | kPa | Joback Calculated Property |
| Inp | 1262.00 | NIST | |
| Tboil | 500.90 | K | Relay (1.0) Calculated Property |
| Tc | 717.62 | K | Relay (1.0) Calculated Property |
| Tfus | 290.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.514 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [322.00; 400.05] | J/mol×K | [531.39; 747.67] | 
|
| Cp,gas | 322.00 | J/mol×K | 531.39 | Joback Calculated Property |
| Cp,gas | 337.22 | J/mol×K | 567.44 | Joback Calculated Property |
| Cp,gas | 351.50 | J/mol×K | 603.48 | Joback Calculated Property |
| Cp,gas | 364.89 | J/mol×K | 639.53 | Joback Calculated Property |
| Cp,gas | 377.41 | J/mol×K | 675.58 | Joback Calculated Property |
| Cp,gas | 389.12 | J/mol×K | 711.63 | Joback Calculated Property |
| Cp,gas | 400.05 | J/mol×K | 747.67 | Joback Calculated Property |
| η | [0.0002294; 0.0042401] | Pa×s | [275.08; 531.39] |
|
| η | 0.0042401 | Pa×s | 275.08 | Joback Calculated Property |
| η | 0.0018807 | Pa×s | 317.80 | Joback Calculated Property |
| η | 0.0010114 | Pa×s | 360.52 | Joback Calculated Property |
| η | 0.0006203 | Pa×s | 403.24 | Joback Calculated Property |
| η | 0.0004178 | Pa×s | 445.95 | Joback Calculated Property |
| η | 0.0003015 | Pa×s | 488.67 | Joback Calculated Property |
| η | 0.0002294 | Pa×s | 531.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanone, 2-methyl-1-phenyl-.
Sources
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