- InChI
- InChI=1S/C9H10O2/c1-2-7-3-4-9(11)8(5-7)6-10/h3-6,11H,2H2,1H3
- InChI Key
- XSTCLZHMZASDDK-UHFFFAOYSA-N
- Formula
- C9H10O2
- SMILES
- CCc1ccc(O)c(C=O)c1
- Molecular Weight1
- 150.17
- 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).
- 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° | -126.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -266.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.30 | kJ/mol | Joback Calculated Property |
| log10WS | -2.06 | Crippen Calculated Property | |
| logPoct/wat | 1.767 | Crippen Calculated Property | |
| McVol | 121.350 | ml/mol | McGowan Calculated Property |
| Pc | 4200.18 | kPa | Joback Calculated Property |
| Inp | 1496.00 | NIST | |
| Tboil | 566.26 | K | Joback Calculated Property |
| Tc | 792.70 | K | Joback Calculated Property |
| Tfus | 383.85 | K | Joback Calculated Property |
| Vc | 0.414 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [282.11; 337.45] | J/mol×K | [566.26; 792.70] | 
|
| Cp,gas | 282.11 | J/mol×K | 566.26 | Joback Calculated Property |
| Cp,gas | 292.99 | J/mol×K | 604.00 | Joback Calculated Property |
| Cp,gas | 303.11 | J/mol×K | 641.74 | Joback Calculated Property |
| Cp,gas | 312.54 | J/mol×K | 679.48 | Joback Calculated Property |
| Cp,gas | 321.36 | J/mol×K | 717.22 | Joback Calculated Property |
| Cp,gas | 329.64 | J/mol×K | 754.96 | Joback Calculated Property |
| Cp,gas | 337.45 | J/mol×K | 792.70 | Joback Calculated Property |
| η | [0.0000604; 0.0015230] | Pa×s | [383.85; 566.26] |
|
| η | 0.0015230 | Pa×s | 383.85 | Joback Calculated Property |
| η | 0.0007301 | Pa×s | 414.25 | Joback Calculated Property |
| η | 0.0003870 | Pa×s | 444.65 | Joback Calculated Property |
| η | 0.0002225 | Pa×s | 475.06 | Joback Calculated Property |
| η | 0.0001368 | Pa×s | 505.46 | Joback Calculated Property |
| η | 0.0000888 | Pa×s | 535.86 | Joback Calculated Property |
| η | 0.0000604 | Pa×s | 566.26 | Joback Calculated Property |
Similar Compounds
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Sources
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