- InChI
- InChI=1S/C12H11NO2/c1-8-4-3-5-9(2)12(8)13-10(14)6-7-11(13)15/h3-7H,1-2H3
- InChI Key
- VMDQUQBEIFMAIC-UHFFFAOYSA-N
- Formula
- C12H11NO2
- SMILES
- Cc1cccc(C)c1N1C(=O)C=CC1=O
- Molecular Weight1
- 201.22
- CAS
- 1206-49-1
- Other Names
-
- 1H-Pyrrole-2,5-dione, 1-(2,6-dimethylphenyl)-
- 1-(2,6-dimethylphenyl)-1H-pyrrole-2,5-dione
- 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 | 0.5779 | Relay (... Calculated Property | |
| ΔfG° | 10.13 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -159.30 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 73.21 | kJ/mol | Relay (... Calculated Property |
| IE | 8.69 | eV | Relay (... Calculated Property |
| log10WS | -2.71 | Relay (... Calculated Property | |
| logPoct/wat | 1.733 | Crippen Calculated Property | |
| McVol | 154.140 | ml/mol | McGowan Calculated Property |
| Pc | 3223.87 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 570.50 | K | Relay (... Calculated Property |
| Tc | 852.73 | K | Relay (... Calculated Property |
| Tfus | 384.57 | K | Relay (... Calculated Property |
| Vc | 0.557 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Maleimide, n-(2,6-xylyl)-.
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
- McGowan Method
- NIST Webbook
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