![Pyrrolidine-5-one, 2-[3-hydroxypropyl]-](/cid/96-951-0/Pyrrolidine-5-one-2-3-hydroxypropyl.png "Pyrrolidine-5-one, 2-[3-hydroxypropyl]-")
- InChI
- InChI=1S/C7H13NO2/c9-5-1-2-6-3-4-7(10)8-6/h6,9H,1-5H2,(H,8,10)
- InChI Key
- CJGLHMSXEHVWKR-UHFFFAOYSA-N
- Formula
- C7H13NO2
- SMILES
- OCCCC1CCC(O)=N1
- Molecular Weight1
- 143.18
- CAS
- 80243-73-8
- Other Names
-
- Pyrrolidin-5-one, 2-[3-hydroxypropyl]-
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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).
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | -91.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -314.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.95 | kJ/mol | Joback Calculated Property |
| log10WS | -1.01 | Crippen Calculated Property | |
| logPoct/wat | 0.878 | Crippen Calculated Property | |
| McVol | 116.050 | ml/mol | McGowan Calculated Property |
| Pc | 4420.84 | kPa | Joback Calculated Property |
| I | 2167.00 | NIST | |
| Tboil | 617.04 | K | Joback Calculated Property |
| Tc | 804.22 | K | Joback Calculated Property |
| Tfus | 386.01 | K | Joback Calculated Property |
| Vc | 0.442 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [323.98; 381.50] | J/mol×K | [617.04; 804.22] | 
|
| Cp,gas | 323.98 | J/mol×K | 617.04 | Joback Calculated Property |
| Cp,gas | 334.97 | J/mol×K | 648.24 | Joback Calculated Property |
| Cp,gas | 345.38 | J/mol×K | 679.43 | Joback Calculated Property |
| Cp,gas | 355.23 | J/mol×K | 710.63 | Joback Calculated Property |
| Cp,gas | 364.53 | J/mol×K | 741.82 | Joback Calculated Property |
| Cp,gas | 373.29 | J/mol×K | 773.02 | Joback Calculated Property |
| Cp,gas | 381.50 | J/mol×K | 804.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pyrrolidine-5-one, 2-[3-hydroxypropyl]-.
Sources
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