Proline (data page)
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| The complete data for Proline (v) | ||||
| General informationChemical formula: C5H9NO2 Molar mass: 115.13 g·mol−1 Systematic name: (S)-Pyrrolidine-2-carboxylic acid Abbreviations: P, Pro Synonyms: ? | ||||
| Database data | ||||
| SMILES: C1CCNC1C(=O)O InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1/f/h7H ATC: N/ACAS: 147-85-3DrugBank: N/AEINECS: 205-702-2 aPubChem: 614 (L) a, 8988 (D)a | ||||
| ATC: N/A | CAS: 147-85-3 | DrugBank: N/A | EINECS: 205-702-2 a | PubChem: 614 (L) a, 8988 (D)a |
| Physical properties | ||||
| StructureCrystal dataSpectral dataUV–VisIRNMRMS - Masses of main fragments:Phase behaviorSolid properties Tm: 221 °CLiquid propertiesGas properties | ||||
| Structure | Crystal data | Spectral dataUV–VisIRNMRMS - Masses of main fragments: | ||
| UV–Vis | IR | NMR | MS - Masses of main fragments: | |
| Phase behavior | Solid properties Tm: 221 °C | Liquid properties | Gas properties | |
| Hazard properties | ||||
| MSDS N/AMain hazards:- N/ANFPA 704Flash point- N/ARTECS number: N/A | ||||
| MSDS N/A | Main hazards:- N/A | NFPA 704 | Flash point- N/A | RTECS number: N/A |
| Chemical properties | ||||
| XLogP: -0.04pI: 6.30pKa: 1.95, 10.47Tautomers:Hydrogen bond: donor - 2; acceptor - 3 | ||||
| XLogP: -0.04 | pI: 6.30 | pKa: 1.95, 10.47 | Tautomers: | Hydrogen bond: donor - 2; acceptor - 3 |
| Pharmacological properties |
- Except where noted otherwise, data relate to Standard temperature and pressure.
- Reliability of data general note.