Ethyl 8-[3-(benzoyloxy)propyl]-8-azabicyclo[3.2.1]oct-3-ene-2-carboxylate

Base Information

• Chemical Name: Ethyl 8-[3-(benzoyloxy)propyl]-8-azabicyclo[3.2.1]oct-3-ene-2-carboxylate
• CAS No.: 550-92-5
• Molecular Formula: C20H25NO4
• Molecular Weight: 343.4
• DSSTox Substance ID: DTXSID10701399
• Nikkaji Number: J166.104C
• Mol file: 550-92-5.mol

Synonyms:550-92-5;Eccaine;DTXSID10701399;8-[3-(Benzoyloxy)propyl]-8-azabicyclo[3.2.1]oct-3-ene-2-carboxylic acid ethyl ester;Ethyl 8-[3-(benzoyloxy)propyl]-8-azabicyclo[3.2.1]oct-3-ene-2-carboxylate

Chemical Property of Ethyl 8-[3-(benzoyloxy)propyl]-8-azabicyclo[3.2.1]oct-3-ene-2-carboxylate

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 343.17835828
• Heavy Atom Count: 25
• Complexity: 498

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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1C=CC2CCC1N2CCCOC(=O)C3=CC=CC=C3

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