4-[(E)-1-(1-benzothiophen-3-yl)but-1-en-2-yl]pyridine

Base Information

• Chemical Name: 4-[(E)-1-(1-benzothiophen-3-yl)but-1-en-2-yl]pyridine
• CAS No.: 59237-08-0
• Molecular Formula: C₁₇H₁₅NS
• Molecular Weight: 265.379
• NSC Number: 276443
• DSSTox Substance ID: DTXSID40422242
• Wikidata: Q82234107

Synonyms:NSC276443;59237-08-0;DTXSID40422242;NSC-276443

Chemical Property of 4-[(E)-1-(1-benzothiophen-3-yl)but-1-en-2-yl]pyridine

Chemical Property:

• Vapor Pressure: 1.43E-06mmHg at 25°C
• Boiling Point: 410.5°C at 760 mmHg
• Flash Point: 186.2°C
• Density: 1.175g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 265.09252066
• Heavy Atom Count: 19
• Complexity: 319

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=CC1=CSC2=CC=CC=C21)C3=CC=NC=C3
• Isomeric SMILES: CC/C(=C\C1=CSC2=CC=CC=C21)/C3=CC=NC=C3

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