- InChI
- InChI=1S/C6H11NO/c1-5-3-4-6(8)7(5)2/h5H,3-4H2,1-2H3
- InChI Key
- FILVIKOEJGORQS-UHFFFAOYSA-N
- Formula
- C6H11NO
- SMILES
- CC1CCC(=O)N1C
- Molecular Weight1
- 113.16
- CAS
- 5075-92-3
- Other Names
-
- 2-Pyrrolidinone, 1,5-dimethyl-
- 1,5-dimethylpyrrolidin-2-one
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.3673 | Relay (1.0) Calculated Property | |
| ΔfG° | -16.57 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -220.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 55.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.627 | Crippen Calculated Property | |
| McVol | 96.090 | ml/mol | McGowan Calculated Property |
| Pc | 3963.64 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 492.04 | K | Relay (1.0) Calculated Property |
| Tc | 683.99 | K | Relay (1.0) Calculated Property |
| Tfus | 272.69 | K | Relay (1.0) Calculated Property |
| Vc | 0.349 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 489.20 | K | 99.10 | NIST |
Similar Compounds
Find more compounds similar to 1,5-Dimethyl-2-pyrrolidinone.
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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