1-{(1R)-1-Carboxy-4-[(diaminomethylene)amino]butyl}-5-oxo-L-proline
[CAS# 86630-17-3]

Identification

• Name: 1-{(1R)-1-Carboxy-4-[(diaminomethylene)amino]butyl}-5-oxo-L-proline
• Synonyms: 1-Pyrrolidineacetic acid, α-(3-((aminoiminomethyl)amino)propyl)-2-carboxy-5-oxo-, (S-(R*,S*))-; N-(4-((Aminoiminomethyl)amino)-1-carboxybutyl)-2-pyrrolidone-5-carboxylic acid; Pyronopaline
• Molecular Formula: C₁₁H₁₈N₄O₅
• Molecular Weight: 286.28
• CAS Registry Number: 86630-17-3
• SMILES: O=C(O)[C@H](N1C(=O)CC[C@H]1C(=O)O)CCC/N=C(\N)N
• InChI: 1S/C11H18N4O5/c12-11(13)14-5-1-2-6(9(17)18)15-7(10(19)20)3-4-8(15)16/h6-7H,1-5H2,(H,17,18)(H,19,20)(H4,12,13,14)/t6-,7+/m1/s1
• InChIKey: GTRMYGUJZGMZEF-RQJHMYQMSA-N

Properties

• Density: 1.62g/cm³ (Cal.)
• Boiling point: 669.031°C at 760 mmHg (Cal.)
• Flash point: 358.417°C (Cal.)