- InChI
- InChI=1S/C11H13NO3/c1-8(13)7-11(14)12-9-5-3-4-6-10(9)15-2/h3-6H,7H2,1-2H3,(H,12,14)
- InChI Key
- KYYRTDXOHQYZPO-UHFFFAOYSA-N
- Formula
- C11H13NO3
- SMILES
- COc1ccccc1N=C(O)CC(C)=O
- Molecular Weight1
- 207.23
- CAS
- 92-15-9
- Other Names
-
- o-Acetoacetanisidide
- o-Methoxyacetoacetanilide
- Acetoacetic acid o-anisidide
- Acetoacetyl-O-anisidide
- Acetoacetyl-O-anisidine
- N-Acetoacetyl-O-anisidine
- 1-Acetoacetylamino-2-methoxybenzene
- 2-Acetoacetylaminoanisole
- 2-Methoxyacetoacetanilide
- Acetoacetic acid 2-methoxyanilide
- Acetoacet-o-anisidide
- o-Anisidine, acetoactyl-
- Acetoacet-o-anisidin
- o-Anisidine, acetoacetyl-
- Acetoacetyl-o-aniside
- Acetoacetyl-o-anisine
- 2'-Methoxyacetoacetanilide
- 2-Methoxyanilid kyseliny acetoctove
- Acetoacet-2-anisidide
- NSC 7563
- 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).
- 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 | 0.7710 | Relay (1.0) Calculated Property | |
| ΔfG° | -118.15 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -373.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 95.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.74 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.262 | Crippen Calculated Property | |
| McVol | 161.080 | ml/mol | McGowan Calculated Property |
| Pc | 2712.67 | kPa | Joback Calculated Property |
| Tboil | 594.39 | K | Relay (1.0) Calculated Property |
| Tc | 817.41 | K | Relay (1.0) Calculated Property |
| Tfus | 390.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.565 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Butanamide, N-(2-methoxyphenyl)-3-oxo-.
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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