6,12-Methano-12H-dibenzo(b,f)thiocin-12-methanamine, 6,11-dihydro-N,N-dimethyl-, (Z)-2-butenedioate (1:1)

Base Information

• Chemical Name: 6,12-Methano-12H-dibenzo(b,f)thiocin-12-methanamine, 6,11-dihydro-N,N-dimethyl-, (Z)-2-butenedioate (1:1)
• CAS No.: 114431-30-0
• Molecular Formula: C23H25NO4S
• Molecular Weight: 411.5139

Synonyms:114431-30-0;6,12-Methano-12H-dibenzo(b,f)thiocin-12-methanamine, 6,11-dihydro-N,N-dimethyl-, (Z)-2-butenedioate (1:1);LS-90898

Chemical Property of 6,12-Methano-12H-dibenzo(b,f)thiocin-12-methanamine, 6,11-dihydro-N,N-dimethyl-, (Z)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 7.26E-07mmHg at 25°C
• Boiling Point: 408°Cat760mmHg
• Flash Point: 200.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 411.15042945
• Heavy Atom Count: 29
• Complexity: 501

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC12CC(C3=CC=CC=C3C1)SC4=CC=CC=C24.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CN(C)CC12CC(C3=CC=CC=C3C1)SC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O

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