2-Methyl-2-propanyl 3-{[1-(4-fluorobenzyl)-1H-benzimidazol-2-yl]amino}-1-pyrrolidinecarboxylate
[CAS# 885270-87-1]

Identification

• Name: 2-Methyl-2-propanyl 3-{[1-(4-fluorobenzyl)-1H-benzimidazol-2-yl]amino}-1-pyrrolidinecarboxylate
• Synonyms: 1-Boc-3-[1-(4-Fluorobenzyl)-1H-benzoimidazol-2-ylamino]pyrrolidine; 1-BOC-3-[1-(4-FLUORO-BENZYL)-1H-BENZOIMIDAZOL-2-YLAMINO]-PYRROLIDINE; 1-Pyrrolidinecarboxylic acid, 3-[[1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl]amino]-, 1,1-dimethylethyl ester
• Molecular Formula: C₂₃H₂₇FN₄O₂
• Molecular Weight: 410.48
• CAS Registry Number: 885270-87-1
• SMILES: CC(C)(C)OC(=O)N1CCC(C1)Nc2nc3ccccc3n2Cc4ccc(cc4)F
• InChI: 1S/C23H27FN4O2/c1-23(2,3)30-22(29)27-13-12-18(15-27)25-21-26-19-6-4-5-7-20(19)28(21)14-16-8-10-17(24)11-9-16/h4-11,18H,12-15H2,1-3H3,(H,25,26)
• InChIKey: SISOIGGGBXCPOY-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 568.9±60.0°C at 760 mmHg (Cal.)
• Flash point: 297.9±32.9°C (Cal.)
• Refractive index: 1.613 (Cal.)