4,6-Bis(methylsulfanyl)-5-nitropyrimidine

Base Information

• Chemical Name: 4,6-Bis(methylsulfanyl)-5-nitropyrimidine
• CAS No.: 88317-72-0
• Molecular Formula: C₆H₇N₃O₂S₂
• Molecular Weight: 217.272
• DSSTox Substance ID: DTXSID00529660
• Wikidata: Q82400244
• Mol file: 88317-72-0.mol

Synonyms:88317-72-0;Pyrimidine, 4,6-bis(methylthio)-5-nitro-;4,6-Bis(methylsulfanyl)-5-nitropyrimidine;bismethylthio-5-nitropyrimidine;DTXSID00529660;AKOS030261721;4,6-Bis(methylthio)-5-nitropyrimidine

Chemical Property of 4,6-Bis(methylsulfanyl)-5-nitropyrimidine

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 216.99796882
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=C(C(=NC=N1)SC)[N+](=O)[O-]