4H-Benzo(5,6)cyclohepta(1,2-d)thiazole, 9,10-dihydro-2-methyl-4-(1-methyl-4-piperidylidene)-, fumarate (1:1)

Base Information

• Chemical Name: 4H-Benzo(5,6)cyclohepta(1,2-d)thiazole, 9,10-dihydro-2-methyl-4-(1-methyl-4-piperidylidene)-, fumarate (1:1)
• CAS No.: 53924-76-8
• Molecular Formula: C23H26N2O4S
• Molecular Weight: 426.5285

Synonyms:4H-Benzo(5,6)cyclohepta(1,2-d)thiazole, 9,10-dihydro-2-methyl-4-(1-methyl-4-piperidylidene)-, fumarate (1:1);53924-76-8;LS-33817

Chemical Property of 4H-Benzo(5,6)cyclohepta(1,2-d)thiazole, 9,10-dihydro-2-methyl-4-(1-methyl-4-piperidylidene)-, fumarate (1:1)

Chemical Property:

• Vapor Pressure: 1.47E-08mmHg at 25°C
• Boiling Point: 457.6°C at 760 mmHg
• Flash Point: 230.5°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 426.16132849
• Heavy Atom Count: 30
• Complexity: 566

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• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(S1)CCC3=CC=CC=C3C2=C4CC[NH+](CC4)C.C(=CC(=O)[O-])C(=O)O
• Isomeric SMILES: CC1=NC2=C(S1)CCC3=CC=CC=C3C2=C4CC[NH+](CC4)C.C(=C/C(=O)[O-])\C(=O)O

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