- InChI
- InChI=1S/C10H10O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
- InChI Key
- FMFHUEMLVAIBFI-BQYQJAHWSA-N
- Formula
- C10H10O2
- SMILES
- CC(=O)OC=Cc1ccccc1
- Molecular Weight1
- 162.19
- CAS
- 10521-96-7
- 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° | -7.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -140.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.24 | kJ/mol | Joback Calculated Property |
| log10WS | -2.49 | Crippen Calculated Property | |
| logPoct/wat | 2.220 | Crippen Calculated Property | |
| McVol | 131.140 | ml/mol | McGowan Calculated Property |
| Pc | 3269.04 | kPa | Joback Calculated Property |
| I | [1692.00; 1692.00] |
|
|
| I | 1692.00 | NIST | |
| I | 1692.00 | NIST | |
| Tboil | 535.33 | K | Joback Calculated Property |
| Tc | 757.99 | K | Joback Calculated Property |
| Tfus | 295.96 | K | Joback Calculated Property |
| Vc | 0.491 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [281.89; 348.24] | J/mol×K | [535.33; 757.99] |
|
| Cp,gas | 281.89 | J/mol×K | 535.33 | Joback Calculated Property |
| Cp,gas | 294.93 | J/mol×K | 572.44 | Joback Calculated Property |
| Cp,gas | 307.12 | J/mol×K | 609.55 | Joback Calculated Property |
| Cp,gas | 318.52 | J/mol×K | 646.66 | Joback Calculated Property |
| Cp,gas | 329.15 | J/mol×K | 683.77 | Joback Calculated Property |
| Cp,gas | 339.04 | J/mol×K | 720.88 | Joback Calculated Property |
| Cp,gas | 348.24 | J/mol×K | 757.99 | Joback Calculated Property |
| η | [0.0001831; 0.0021489] | Pa×s | [295.96; 535.33] |
|
| η | 0.0021489 | Pa×s | 295.96 | Joback Calculated Property |
| η | 0.0011171 | Pa×s | 335.86 | Joback Calculated Property |
| η | 0.0006673 | Pa×s | 375.75 | Joback Calculated Property |
| η | 0.0004400 | Pa×s | 415.65 | Joback Calculated Property |
| η | 0.0003121 | Pa×s | 455.54 | Joback Calculated Property |
| η | 0.0002340 | Pa×s | 495.44 | Joback Calculated Property |
| η | 0.0001831 | Pa×s | 535.33 | Joback Calculated Property |
Similar Compounds
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Sources
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