Semioxamazide, 5-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenethyl)-1-(p-tolylsulfonyl)-, L-(+)-threo-

Base Information

• Chemical Name: Semioxamazide, 5-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenethyl)-1-(p-tolylsulfonyl)-, L-(+)-threo-
• CAS No.: 60199-34-0
• Molecular Formula: C18H20N4O8S
• Molecular Weight: 452.4384
• DSSTox Substance ID: DTXSID80208941
• Wikidata: Q83083088

Synonyms:60199-34-0;Semioxamazide, 5-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenethyl)-1-(p-tolylsulfonyl)-, L-(+)-threo-;C18-H20-N4-O8-S;DTXSID80208941

Chemical Property of Semioxamazide, 5-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenethyl)-1-(p-tolylsulfonyl)-, L-(+)-threo-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.493g/cm³
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 452.10018478
• Heavy Atom Count: 31
• Complexity: 735

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C(=O)NC(CO)C(C2=CC=C(C=C2)[N+](=O)[O-])O
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C(=O)N[C@@H](CO)[C@H](C2=CC=C(C=C2)[N+](=O)[O-])O

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