Methyl (1R,2S,3S)-8-(3-Fluoropropyl)-3-(4-Iodophenyl)-8-Azabicyclo[3.2.1]Octane-2-Carboxylate
[CAS# 155797-99-2]

Identification

• Name: Methyl (1R,2S,3S)-8-(3-Fluoropropyl)-3-(4-Iodophenyl)-8-Azabicyclo[3.2.1]Octane-2-Carboxylate
• Synonyms: (1R,2S,3S)-8-(3-Fluoropropyl)-3-(4-Iodophenyl)-8-Azabicyclo[3.2.1]Octane-2-Carboxylic Acid Methyl Ester; (123I)Fp-Cit; (O-Methyl-11C)Beta-Cit-Fp
• Molecular Formula: C₁₈H₂₃FINO₂
• Molecular Weight: 431.29
• CAS Registry Number: 155797-99-2
• SMILES: [C@H]1([C@@H]3N(C(C[C@@H]1C2=CC=C(C=C2)I)CC3)CCCF)C(=O)OC
• InChI: 1S/C18H23FINO2/c1-23-18(22)17-15(12-3-5-13(20)6-4-12)11-14-7-8-16(17)21(14)10-2-9-19/h3-6,14-17H,2,7-11H2,1H3/t14?,15-,16-,17+/m1/s1
• InChIKey: HXWLAJVUJSVENX-IFFAKLHKSA-N

Properties

• Density: 1.45g/cm³ (Cal.)
• Boiling point: 446.698°C at 760 mmHg (Cal.)
• Flash point: 223.955°C (Cal.)