8-[(2,2-Diethoxyethyl)sulfanyl]-9-oxonon-5-enenitrile

Base Information

• Chemical Name: 8-[(2,2-Diethoxyethyl)sulfanyl]-9-oxonon-5-enenitrile
• CAS No.: 61546-46-1
• Molecular Formula: C15H25NO3S
• Molecular Weight: 299.42900
• DSSTox Substance ID: DTXSID20709543

Synonyms:61546-46-1;8-[(2,2-Diethoxyethyl)sulfanyl]-9-oxonon-5-enenitrile;DTXSID20709543

Chemical Property of 8-[(2,2-Diethoxyethyl)sulfanyl]-9-oxonon-5-enenitrile

Chemical Property:

• Boiling Point: 422.9±45.0 °C(Predicted)
• PSA: 84.62000
• Density: 1.040±0.06 g/cm3(Predicted)
• LogP: 3.32638
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 13
• Exact Mass: 299.15551483
• Heavy Atom Count: 20
• Complexity: 306

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(CSC(CC=CCCCC#N)C=O)OCC

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