5-(Butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Base Information

• Chemical Name: 5-(Butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
• CAS No.: 5305-26-0
• Molecular Formula: C15H23 N O S . Cl H
• Molecular Weight: 227.2834
• DSSTox Substance ID: DTXSID30416296

Synonyms:5-(butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione;5305-26-0;5-(butyliminomethyl)-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one;DTXSID30416296;SR-01000203710;SR-01000203710-1

Chemical Property of 5-(Butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Chemical Property:

• Density: 1.3g/cm³
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 227.07284784
• Heavy Atom Count: 15
• Complexity: 336

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN=CC1=C(NC(=S)NC1=O)O

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