2H-1,2,5-Thiadiazino(5,6-a)benzimidazole, 3,4-dihydro-2-ethyl-7-nitro-3-(4-nitrophenyl)-, 1,1-dioxide

Base Information

• Chemical Name: 2H-1,2,5-Thiadiazino(5,6-a)benzimidazole, 3,4-dihydro-2-ethyl-7-nitro-3-(4-nitrophenyl)-, 1,1-dioxide
• CAS No.: 115242-30-3
• Molecular Formula: C17H13 N5 O6 S
• Molecular Weight: 415.38
• DSSTox Substance ID: DTXSID90151010
• Wikidata: Q83017395

Synonyms:115242-30-3;2H-1,2,5-Thiadiazino(5,6-a)benzimidazole, 3,4-dihydro-2-ethyl-7-nitro-3-(4-nitrophenyl)-, 1,1-dioxide;SCHEMBL10466133;C17H13N5O6S;DTXSID90151010;LS-150200

Chemical Property of 2H-1,2,5-Thiadiazino(5,6-a)benzimidazole, 3,4-dihydro-2-ethyl-7-nitro-3-(4-nitrophenyl)-, 1,1-dioxide

Chemical Property:

• Vapor Pressure: 2.57E-21mmHg at 25°C
• Boiling Point: 732.5°C at 760 mmHg
• Flash Point: 396.8°C
• Density: 1.67g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 415.05865433
• Heavy Atom Count: 29
• Complexity: 808

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C(=CN2C3=C(C=CC(=C3)[N+](=O)[O-])N=C2S1(=O)=O)C4=CC=C(C=C4)[N+](=O)[O-]

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