(5E)-5-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

Base Information

• Chemical Name: (5E)-5-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
• CAS No.: 6235-75-2
• Molecular Formula: C20H18N2O6S2
• Molecular Weight: 446.4967
• DSSTox Substance ID: DTXSID90367553
• Wikidata: Q82153472

Synonyms:6235-75-2;(5E)-5-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one;(5E)-5-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one;Ambcb6235752;DTXSID90367553;BIM-0033103.P001

Chemical Property of (5E)-5-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

Chemical Property:

• Vapor Pressure: 2.1E-16mmHg at 25°C
• Boiling Point: 642.6°C at 760 mmHg
• Flash Point: 342.4°C
• Density: 1.45g/cm³
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 446.06062865
• Heavy Atom Count: 30
• Complexity: 675

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=O)C(=CC2=CC(=C(C=C2)OCCOC3=CC=C(C=C3)[N+](=O)[O-])OC)SC1=S
• Isomeric SMILES: CN1C(=O)/C(=C\C2=CC(=C(C=C2)OCCOC3=CC=C(C=C3)[N+](=O)[O-])OC)/SC1=S

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