- InChI
- InChI=1S/C12H25NO/c1-4-5-6-7-8-9-10-11-12(2)13-14-3/h4-11H2,1-3H3
- InChI Key
- BUQLFBNCEBFRNA-UHFFFAOYSA-N
- Formula
- C12H25NO
- SMILES
- CCCCCCCCCC(C)=NOC
- Molecular Weight1
- 199.33
- CAS
- 153953-62-9
- Other Names
-
- 2-undecanone O-methyloxime
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : 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).
- 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 |
|---|---|---|---|
| ω | 0.6917 | Relay (1.0) Calculated Property | |
| ΔfG° | 125.39 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -223.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 65.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.33 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.149 | Crippen Calculated Property | |
| McVol | 191.490 | ml/mol | McGowan Calculated Property |
| Pc | 1616.77 | kPa | Joback Calculated Property |
| I | [2163.00; 2163.00] |
|
|
| I | 2163.00 | NIST | |
| I | 2163.00 | NIST | |
| Tboil | 495.10 | K | Relay (1.0) Calculated Property |
| Tc | 677.48 | K | Relay (1.0) Calculated Property |
| Tfus | 263.86 | K | Relay (1.0) Calculated Property |
| Vc | 0.732 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Undecanone, 2-methyl 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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