- InChI
- InChI=1S/C10H12O/c1-8(2)10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
- InChI Key
- BSMGLVDZZMBWQB-UHFFFAOYSA-N
- Formula
- C10H12O
- SMILES
- CC(C)C(=O)c1ccccc1
- Molecular Weight1
- 148.20
- CAS
- 611-70-1
- Other Names
-
- 1-Propanone, 2-methyl-1-phenyl-
- Isobutyrophenone
- «alpha»-Methylpropiophenone
- Phenyl isopropyl ketone
- 2-Methylpropiophenone
- 2-Methyl-1-phenyl-1-propanone
- BasG : Gas basicity (kJ/mol).
- 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| BasG | 839.30 | kJ/mol | NIST |
| ΔfG° | 14.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -131.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.49 | kJ/mol | Joback Calculated Property |
| log10WS | -2.73 | Crippen Calculated Property | |
| logPoct/wat | 2.525 | Crippen Calculated Property | |
| McVol | 129.570 | ml/mol | McGowan Calculated Property |
| Pc | 3170.40 | kPa | Joback Calculated Property |
| Inp | [1174.00; 1185.00] |
|
|
| Inp | 1185.00 | NIST | |
| Inp | 1174.00 | NIST | |
| Inp | 1185.00 | NIST | |
| Tboil | 490.20 | K | NIST |
| Tc | 728.18 | K | Joback Calculated Property |
| Tfus | 263.81 | K | Joback Calculated Property |
| Vc | 0.487 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.87; 350.22] | J/mol×K | [508.31; 728.18] |
|
| Cp,gas | 276.87 | J/mol×K | 508.31 | Joback Calculated Property |
| Cp,gas | 291.21 | J/mol×K | 544.95 | Joback Calculated Property |
| Cp,gas | 304.66 | J/mol×K | 581.60 | Joback Calculated Property |
| Cp,gas | 317.24 | J/mol×K | 618.24 | Joback Calculated Property |
| Cp,gas | 329.01 | J/mol×K | 654.89 | Joback Calculated Property |
| Cp,gas | 339.99 | J/mol×K | 691.53 | Joback Calculated Property |
| Cp,gas | 350.22 | J/mol×K | 728.18 | Joback Calculated Property |
| η | [0.0002449; 0.0042828] | Pa×s | [263.81; 508.31] |
|
| η | 0.0042828 | Pa×s | 263.81 | Joback Calculated Property |
| η | 0.0019321 | Pa×s | 304.56 | Joback Calculated Property |
| η | 0.0010518 | Pa×s | 345.31 | Joback Calculated Property |
| η | 0.0006510 | Pa×s | 386.06 | Joback Calculated Property |
| η | 0.0004416 | Pa×s | 426.81 | Joback Calculated Property |
| η | 0.0003205 | Pa×s | 467.56 | Joback Calculated Property |
| η | 0.0002449 | Pa×s | 508.31 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [359.20; 493.20] | K | [0.50; 99.50] |
|
| Tboilr | 359.20 | K | 0.50 | NIST |
| Tboilr | 493.20 | K | 99.50 | NIST |
Similar Compounds
Find more compounds similar to Isopropyl phenyl ketone.
Sources
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