3-{[(4R)-4-Hydroxy-L-prolyl]amino}benzoic acid
[CAS# 770703-11-2]

Identification

• Name: 3-{[(4R)-4-Hydroxy-L-prolyl]amino}benzoic acid
• Synonyms: 3-((2S,4R)-4-hydroxypyrrolidine-2-carboxamido)benzoic acid
• Molecular Formula: C₁₂H₁₄N₂O₄
• Molecular Weight: 250.25
• CAS Registry Number: 770703-11-2
• SMILES: O=C(Nc1cc(C(=O)O)ccc1)[C@H]2NC[C@H](O)C2
• InChI: 1S/C12H14N2O4/c15-9-5-10(13-6-9)11(16)14-8-3-1-2-7(4-8)12(17)18/h1-4,9-10,13,15H,5-6H2,(H,14,16)(H,17,18)/t9-,10+/m1/s1
• InChIKey: IQPYLVCJTJLSDO-ZJUUUORDSA-N

Properties

• Density: 1.448g/cm³ (Cal.)
• Boiling point: 594.035°C at 760 mmHg (Cal.)
• Flash point: 313.061°C (Cal.)
• Refractive index: 1.663 (Cal.)