- InChI
- InChI=1S/C10H10O/c1-7-3-2-4-9-8(7)5-6-10(9)11/h2-4H,5-6H2,1H3
- InChI Key
- RUORWXQKVXTQJJ-UHFFFAOYSA-N
- Formula
- C10H10O
- SMILES
- Cc1cccc2c1CCC2=O
- Molecular Weight1
- 146.19
- CAS
- 24644-78-8
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | 72.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -80.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.92 | kJ/mol | Joback Calculated Property |
| log10WS | -2.89 | Crippen Calculated Property | |
| logPoct/wat | 2.124 | Crippen Calculated Property | |
| McVol | 118.710 | ml/mol | McGowan Calculated Property |
| Pc | 3547.31 | kPa | Joback Calculated Property |
| Inp | 1444.00 | NIST | |
| Tboil | 544.07 | K | Joback Calculated Property |
| Tc | 785.60 | K | Joback Calculated Property |
| Tfus | 344.32 | K | Joback Calculated Property |
| Vc | 0.453 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.86; 340.20] | J/mol×K | [544.07; 785.60] | 
|
| Cp,gas | 267.86 | J/mol×K | 544.07 | Joback Calculated Property |
| Cp,gas | 282.04 | J/mol×K | 584.33 | Joback Calculated Property |
| Cp,gas | 295.31 | J/mol×K | 624.58 | Joback Calculated Property |
| Cp,gas | 307.73 | J/mol×K | 664.84 | Joback Calculated Property |
| Cp,gas | 319.32 | J/mol×K | 705.09 | Joback Calculated Property |
| Cp,gas | 330.13 | J/mol×K | 745.35 | Joback Calculated Property |
| Cp,gas | 340.20 | J/mol×K | 785.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-methylindanone.
Sources
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