![Propanoic acid, 2-[[(1-methylethylidene)amino]oxy]-, ethyl ester](/cid/44-426-0/Propanoic-acid-2-1-methylethylidene-amino-oxy-ethyl-ester.png "Propanoic acid, 2-[[(1-methylethylidene)amino]oxy]-, ethyl ester")
- InChI
- InChI=1S/C8H15NO3/c1-5-11-8(10)7(4)12-9-6(2)3/h7H,5H2,1-4H3
- InChI Key
- YXSVQLSROJMFIP-UHFFFAOYSA-N
- Formula
- C8H15NO3
- SMILES
- CCOC(=O)C(C)ON=C(C)C
- Molecular Weight1
- 173.21
- CAS
- 54716-29-9
- Other Names
-
- Ethyl «alpha»-[isopropylideneaminooxy]propionate
- Propionic acid, 2-[(isopropylideneamino)oxy]- ethyl ester
- 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 | 0.5447 | Relay (1.0) Calculated Property | |
| ΔfG° | -235.14 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -473.08 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 61.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.350 | Crippen Calculated Property | |
| McVol | 142.570 | ml/mol | McGowan Calculated Property |
| Pc | 2381.86 | kPa | Joback Calculated Property |
| Tboil | 458.49 | K | Relay (1.0) Calculated Property |
| Tc | 631.53 | K | Relay (1.0) Calculated Property |
| Tfus | 284.64 | K | Relay (1.0) Calculated Property |
| Vc | 0.547 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 2-[[(1-methylethylidene)amino]oxy]-, ethyl ester.
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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