- InChI
- InChI=1S/C10H9NO3/c12-9(6-7-10(13)14)11-8-4-2-1-3-5-8/h1-7H,(H,11,12)(H,13,14)/b7-6-
- InChI Key
- WHZLCOICKHIPRL-SREVYHEPSA-N
- Formula
- C10H9NO3
- SMILES
- O=C(O)C=CC(O)=Nc1ccccc1
- Molecular Weight1
- 191.18
- CAS
- 555-59-9
- Other Names
-
- Maleanilic acid
- 4-Oxo-4-phenylamino-2-butenoic acid
- 2-Butenoic acid, 4-oxo-4-(phenylamino)-, (Z)-
- Maleamic acid, N-phenyl-
- Maleanilinic acid
- Maleic acid monoanilide
- 4-oxo-4-(phenylamino)isocrotonic acid
- 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 | 0.8497 | Relay (1.0) Calculated Property | |
| ΔfG° | -153.50 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -367.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 116.64 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.37 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.915 | Crippen Calculated Property | |
| McVol | 142.690 | ml/mol | McGowan Calculated Property |
| Pc | 3682.02 | kPa | Joback Calculated Property |
| Tboil | 585.37 | K | Relay (1.0) Calculated Property |
| Tc | 843.55 | K | Relay (1.0) Calculated Property |
| Tfus | 466.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.481 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N-Phenylmaleamic acid.
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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