1-Thiocoumarin, 4-morpholino-3-nitro-

Base Information

• Chemical Name: 1-Thiocoumarin, 4-morpholino-3-nitro-
• CAS No.: 66285-06-1
• Molecular Formula: C13H12N2O4S
• Molecular Weight: 292.3104
• DSSTox Substance ID: DTXSID10216493
• Wikidata: Q83092723
• ChEMBL ID: CHEMBL1418344

Synonyms:1-Thiocoumarin, 4-morpholino-3-nitro-;4-Morpholino-3-nitro-1-thiocoumarin;BRN 1149133;66285-06-1;CBMicro_037560;Oprea1_795850;MLS000974582;CHEMBL1418344;DTXSID10216493;HMS2848I03;STK780174;AKOS001747597;NCGC00245612-01;SMR000496809;BIM-0037683.P001;4-morpholino-3-nitro-2H-thiochromen-2-one;LS-152621;4-(4-morpholinyl)-3-nitro-2H-thiochromen-2-one;4-(morpholin-4-yl)-3-nitro-2H-thiochromen-2-one

Chemical Property of 1-Thiocoumarin, 4-morpholino-3-nitro-

Chemical Property:

• Vapor Pressure: 9.15E-07mmHg at 25°C
• Boiling Point: 404.9°Cat760mmHg
• Flash Point: 198.7°C
• Density: 1.49g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 292.05177804
• Heavy Atom Count: 20
• Complexity: 454

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1COCCN1C2=C(C(=O)SC3=CC=CC=C32)[N+](=O)[O-]

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