[1R,5S,(+)]-Tropane-2a-Yl 1-Adamantanecarboxylate
[CAS# 87395-60-6]

Identification

• Name: [1R,5S,(+)]-Tropane-2a-Yl 1-Adamantanecarboxylate
• Synonyms: 1-Adamantanecarboxylic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-2-Yl) Ester; Adamantane-1-Carboxylic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-2-Yl) Ester; 1-Alpha-H,5-Alpha-H-Tropan-2-Alpha-Ol, 1-Adamantanecarboxylate (+)-
• Molecular Formula: C₁₉H₂₉NO₂
• Molecular Weight: 303.44
• CAS Registry Number: 87395-60-6
• SMILES: CN4C5C(OC(=O)C12CC3CC(C1)CC(C2)C3)CCC4CC5
• InChI: 1S/C19H29NO2/c1-20-15-2-4-16(20)17(5-3-15)22-18(21)19-9-12-6-13(10-19)8-14(7-12)11-19/h12-17H,2-11H2,1H3
• InChIKey: UIGHAFKYTZOCKS-UHFFFAOYSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 390.002°C at 760 mmHg (Cal.)
• Flash point: 126.324°C (Cal.)