- InChI
- InChI=1S/C8H9NO/c1-7(9-10)8-5-3-2-4-6-8/h2-6,10H,1H3
- InChI Key
- JHNRZXQVBKRYKN-UHFFFAOYSA-N
- Formula
- C8H9NO
- SMILES
- CC(=NO)c1ccccc1
- Molecular Weight1
- 135.16
- CAS
- 613-91-2
- Other Names
-
- Acetophenone, oxime
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5809 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -4414.00 | kJ/mol | NIST |
| ΔfG° | 225.78 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 58.11 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -41.00 | kJ/mol | NIST |
| ΔvapH° | 69.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.885 | Crippen Calculated Property | |
| McVol | 111.370 | ml/mol | McGowan Calculated Property |
| Pc | 3615.89 | kPa | Joback Calculated Property |
| Inp | 1310.00 | NIST | |
| Tboil | 524.06 | K | Relay (1.0) Calculated Property |
| Tc | 746.76 | K | Relay (1.0) Calculated Property |
| Tfus | 311.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.395 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Ethanone, 1-phenyl-, oxime.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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