Netica Solution

The complete data for Proline

General information

Chemical 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/A
 CAS: 147-85-3
 DrugBank: N/A
 EINECS: 205-702-2
 PubChem: 614 (L)
Physical properties
Structure
Crystal data
Spectral data
UV-Vis
IR
NMR
MS
Phase behavior
Solid properties
Tm: 221 °C
Liquid properties
Gas properties
Hazard properties
MSDS N/A
Main hazards:
- N/A
NFPA 704

Flash point
- N/A
R/S statement
R: N/A
S: N/A
RTECS number:
N/A
Chemical properties
XLogP: -0.04
pI: 6.30
pKa: 1.95, 10.47
Tautomers: ?
Hydrogen bond: donor – 2;   acceptor – 3;
Pharmacological [...]