- InChI
- InChI=1S/C10H10O3/c1-7(11)6-10(13)8-4-2-3-5-9(8)12/h2-5,12H,6H2,1H3
- InChI Key
- FAIACLOKYTYHSR-UHFFFAOYSA-N
- Formula
- C10H10O3
- SMILES
- CC(=O)CC(=O)c1ccccc1O
- Molecular Weight1
- 178.18
- CAS
- 16636-62-7
- Other Names
-
- o-Hydroxybenzoylacetone
- 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).
- 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° | -266.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -415.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.64 | kJ/mol | Joback Calculated Property |
| log10WS | -1.80 | Crippen Calculated Property | |
| logPoct/wat | 1.554 | Crippen Calculated Property | |
| McVol | 137.010 | ml/mol | McGowan Calculated Property |
| Pc | 4046.64 | kPa | Joback Calculated Property |
| Tboil | 643.24 | K | Joback Calculated Property |
| Tc | 876.58 | K | Joback Calculated Property |
| Tfus | 440.46 | K | Joback Calculated Property |
| Vc | 0.466 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [339.24; 394.38] | J/mol×K | [643.24; 876.58] | 
|
| Cp,gas | 339.24 | J/mol×K | 643.24 | Joback Calculated Property |
| Cp,gas | 350.12 | J/mol×K | 682.13 | Joback Calculated Property |
| Cp,gas | 360.21 | J/mol×K | 721.02 | Joback Calculated Property |
| Cp,gas | 369.59 | J/mol×K | 759.91 | Joback Calculated Property |
| Cp,gas | 378.36 | J/mol×K | 798.80 | Joback Calculated Property |
| Cp,gas | 386.59 | J/mol×K | 837.69 | Joback Calculated Property |
| Cp,gas | 394.38 | J/mol×K | 876.58 | Joback Calculated Property |
| η | [0.0000348; 0.0007511] | Pa×s | [440.46; 643.24] |
|
| η | 0.0007511 | Pa×s | 440.46 | Joback Calculated Property |
| η | 0.0003752 | Pa×s | 474.26 | Joback Calculated Property |
| η | 0.0002055 | Pa×s | 508.05 | Joback Calculated Property |
| η | 0.0001214 | Pa×s | 541.85 | Joback Calculated Property |
| η | 0.0000762 | Pa×s | 575.65 | Joback Calculated Property |
| η | 0.0000504 | Pa×s | 609.44 | Joback Calculated Property |
| η | 0.0000348 | Pa×s | 643.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to o-Acetoacetylphenol.
Sources
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