1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, diphenylfluoroacetate (ester), (+)-

Base Information

• Chemical Name: 1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, diphenylfluoroacetate (ester), (+)-
• CAS No.: 87421-57-6
• Molecular Formula: C22H24FNO2
• Molecular Weight: 353.4299
• DSSTox Substance ID: DTXSID501007553
• Wikidata: Q76278577
• Mol file: 87421-57-6.mol

Synonyms:87421-57-6;BRN 5611757;1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, diphenylfluoroacetate (ester), (+)-;Acetic acid, fluorodiphenyl-, 1-alpha-H,5-alpha-H-tropan-2-alpha-yl ester, (+)-;DTXSID501007553;8-Methyl-8-azabicyclo[3.2.1]octan-2-yl fluoro(diphenyl)acetate;[(1R,2S,5S)-8-Methyl-8-azabicyclo[3.2.1]oct-2-yl]2-fluoro-2,2-dipheny L-acetate

Chemical Property of 1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, diphenylfluoroacetate (ester), (+)-

Chemical Property:

• Vapor Pressure: 1.06E-08mmHg at 25°C
• Boiling Point: 461.5°Cat760mmHg
• Flash Point: 232.9°C
• PSA: 29.54000
• Density: 1.2g/cm³
• LogP: 4.00600
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 353.17910717
• Heavy Atom Count: 26
• Complexity: 480

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2CCC1C(CC2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)F
• Isomeric SMILES: CN1[C@H]2CC[C@@H]1[C@H](CC2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)F

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