- InChI
- InChI=1S/C11H14O/c1-4-11(12)10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3
- InChI Key
- CBALKMGGDUMBIJ-UHFFFAOYSA-N
- Formula
- C11H14O
- SMILES
- CCC(=O)c1ccc(C)c(C)c1
- Molecular Weight1
- 162.23
- 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).
- 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° | 5.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -169.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.43 | kJ/mol | Joback Calculated Property |
| log10WS | -3.50 | Crippen Calculated Property | |
| logPoct/wat | 2.896 | Crippen Calculated Property | |
| McVol | 143.660 | ml/mol | McGowan Calculated Property |
| Pc | 2741.15 | kPa | Joback Calculated Property |
| I | 2658.00 | NIST | |
| Tboil | 541.59 | K | Joback Calculated Property |
| Tc | 755.27 | K | Joback Calculated Property |
| Tfus | 315.12 | K | Joback Calculated Property |
| Vc | 0.549 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [321.49; 395.29] | J/mol×K | [541.59; 755.27] | 
|
| Cp,gas | 321.49 | J/mol×K | 541.59 | Joback Calculated Property |
| Cp,gas | 335.63 | J/mol×K | 577.20 | Joback Calculated Property |
| Cp,gas | 349.01 | J/mol×K | 612.82 | Joback Calculated Property |
| Cp,gas | 361.64 | J/mol×K | 648.43 | Joback Calculated Property |
| Cp,gas | 373.55 | J/mol×K | 684.05 | Joback Calculated Property |
| Cp,gas | 384.76 | J/mol×K | 719.66 | Joback Calculated Property |
| Cp,gas | 395.29 | J/mol×K | 755.27 | Joback Calculated Property |
| η | [0.0002302; 0.0017381] | Pa×s | [315.12; 541.59] |
|
| η | 0.0017381 | Pa×s | 315.12 | Joback Calculated Property |
| η | 0.0010363 | Pa×s | 352.87 | Joback Calculated Property |
| η | 0.0006829 | Pa×s | 390.61 | Joback Calculated Property |
| η | 0.0004843 | Pa×s | 428.36 | Joback Calculated Property |
| η | 0.0003631 | Pa×s | 466.10 | Joback Calculated Property |
| η | 0.0002843 | Pa×s | 503.85 | Joback Calculated Property |
| η | 0.0002302 | Pa×s | 541.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-(3,4-Dimethylphenyl)-1-propanone.
Sources
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