2-Methyl-2-propanyl 3-{[(4-fluorobenzyl)amino]methyl}-1-azetidinecarboxylate
[CAS# 887590-16-1]

Identification

• Name: 2-Methyl-2-propanyl 3-{[(4-fluorobenzyl)amino]methyl}-1-azetidinecarboxylate
• Synonyms: 1-Azetidinecarboxylic acid, 3-[[[(4-fluorophenyl)methyl]amino]methyl]-, 1,1-dimethylethyl ester; 1-AZETIDINECARBOXYLICACID, 3-[[[(4-FLUOROPHENYL)METHYL]AMINO]METHYL]-, 1,1-DIMETHYLETHYL ESTER; 1-BOC-3-[(4-FLUOROBENZYL-AMINO)-METHYL]-AZETIDINE
• Molecular Formula: C₁₆H₂₃FN₂O₂
• Molecular Weight: 294.36
• CAS Registry Number: 887590-16-1
• SMILES: CC(C)(C)OC(=O)N1CC(C1)CNCc2ccc(cc2)F
• InChI: 1S/C16H23FN2O2/c1-16(2,3)21-15(20)19-10-13(11-19)9-18-8-12-4-6-14(17)7-5-12/h4-7,13,18H,8-11H2,1-3H3
• InChIKey: HECUFLGFQXRLNB-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 380.0±17.0°C at 760 mmHg (Cal.)
• Flash point: 183.6±20.9°C (Cal.)
• Refractive index: 1.523 (Cal.)