beta-8-(p-Methylbenzyl)tropinium bromide benzoate

Base Information

• Chemical Name: beta-8-(p-Methylbenzyl)tropinium bromide benzoate
• CAS No.: 100659-29-8
• Molecular Formula: C23H28 N O2 . Br
• Molecular Weight: 430.3779

Synonyms:beta-8-(p-Methylbenzyl)tropinium bromide benzoate;N-863;N-867;alpha-8-(p-Methylbenzyl)tropinium bromide benzoate;1-alpha-H,5-alpha-H-Tropanium, 3-hydroxy-8-(p-methylbenzyl)-, bromide, benzoate (ester), cis-;Tropinium, 8-(p-methylbenzyl)-, bromide, benzoate, cis-;Tropinium, 8-(p-methylbenzyl)-, bromide, benzoate, trans-;1-alpha-H,5-alpha-H-Tropanium, 3-hydroxy-8-(p-methylbenzyl)-, bromide, benzoate (ester), trans-;100659-29-8;100659-30-1;8-(p-Methylbenzyl)pseudotropinium bromide, benzoate;C23-H28-N-O2.Br;LS-157868;LS-157869

Chemical Property of beta-8-(p-Methylbenzyl)tropinium bromide benzoate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 429.13034
• Heavy Atom Count: 27
• Complexity: 476

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C[N+]2(C3CCC2CC(C3)OC(=O)C4=CC=CC=C4)C.[Br-]
• Isomeric SMILES: CC1=CC=C(C=C1)C[N+]2([C@@H]3CC[C@H]2CC(C3)OC(=O)C4=CC=CC=C4)C.[Br-]

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